3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-
TL;DR: 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- (CAS 89399-91-7) is a chemical compound with molecular formula C12H13N3 and molecular weight 199.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine
Also Known As: 1,4,5,6-tetrahydro-n-phenyl-3-cyclopentapyrazolamine, N-phenyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-amine, 3-CYCLOPENTAPYRAZOLAMINE, 1,4,5,6-TETRAHYDRO-N-PHENYL-
| Molecular Formula | C12H13N3 |
|---|---|
| Molecular Weight | 199.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 40.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.11095 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 89399-91-7 |
|---|---|
| SMILES | C1CC2=C(C1)NN=C2NC3=CC=CC=C3 |
| InChIKey | FRUIYRXGLWBINX-UHFFFAOYSA-N |
Product Overview
3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- (CAS 89399-91-7), with molecular formula C12H13N3 and molecular weight 199.11 g/mol. IUPAC: N-phenyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-amine.
Chemical Property Profile of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-
Property Insights of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-. With a topological polar surface area (TPSA) of 40.7 Ų, 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-?
The CAS number of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- is 89399-91-7.
What is the molecular formula of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-?
The molecular formula of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- is C12H13N3.
What is the molecular weight of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-?
The molecular weight of 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- is 199.11 g/mol.
Where can I buy 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-?
You can request a quote for 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Cyclopentapyrazolamine, 1,4,5,6-tetrahydro-N-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.