3-Methylbutanimidamide
TL;DR: 3-Methylbutanimidamide (CAS 67777-12-2) is a chemical compound with molecular formula C5H12N2 and molecular weight 100.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylbutanimidamide
Also Known As: 3-methylbutanimidamide, 3-methylbutanamidine, 3-METHYL-BUTYRAMIDINE, N-Ethyl-N-phenylurethane, 3-Methylbutanimidamide x1hcl
| Molecular Formula | C5H12N2 |
|---|---|
| Molecular Weight | 100.10 g/mol |
| LogP | 0.96847 |
| Topological Polar Surface Area | 49.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 100.10005 |
| Heavy Atoms | 7 |
| Complexity | 66.48041 |
Chemical Identifiers
| CAS Number | 67777-12-2 |
|---|---|
| SMILES | CC(C)CC(=N)N |
Product Overview
3-Methylbutanimidamide (CAS 67777-12-2), with molecular formula C5H12N2 and molecular weight 100.10 g/mol. IUPAC: 3-methylbutanimidamide.
Chemical Property Profile of 3-Methylbutanimidamide
Property Insights of 3-Methylbutanimidamide
The XLogP value of 0.96847 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylbutanimidamide. With a topological polar surface area (TPSA) of 49.87 Ų, 3-Methylbutanimidamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylbutanimidamide has 2 hydrogen bond donor(s) and 1 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-Methylbutanimidamide?
The CAS number of 3-Methylbutanimidamide is 67777-12-2.
What is the molecular formula of 3-Methylbutanimidamide?
The molecular formula of 3-Methylbutanimidamide is C5H12N2.
What is the molecular weight of 3-Methylbutanimidamide?
The molecular weight of 3-Methylbutanimidamide is 100.10 g/mol.
Where can I buy 3-Methylbutanimidamide?
You can request a quote for 3-Methylbutanimidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylbutanimidamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylbutanimidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.