3-(Adamantan-1-ylamino)-propionitrile
TL;DR: 3-(Adamantan-1-ylamino)-propionitrile (CAS 32901-14-7) is a chemical compound with molecular formula C13H20N2 and molecular weight 204.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-adamantylamino)propanenitrile
Also Known As: 3-(Adamantan-1-ylamino)-propionitrile, 3-(1-adamantylamino)propanenitrile, 3-(Adamantan-1-ylamino)propanenitrile, 3-[(adamantan-1-yl)amino]propanenitrile, 3-[N-(adamantyl)amino]propionitrile
| Molecular Formula | C13H20N2 |
|---|---|
| Molecular Weight | 204.16 g/mol |
| LogP | 2.45848 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.16264 |
| Heavy Atoms | 15 |
| Complexity | 254.1171 |
Chemical Identifiers
| CAS Number | 32901-14-7 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NCCC#N |
Product Overview
3-(Adamantan-1-ylamino)-propionitrile (CAS 32901-14-7), with molecular formula C13H20N2 and molecular weight 204.16 g/mol. IUPAC: 3-(1-adamantylamino)propanenitrile.
Chemical Property Profile of 3-(Adamantan-1-ylamino)-propionitrile
Property Insights of 3-(Adamantan-1-ylamino)-propionitrile
The XLogP value of 2.45848 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Adamantan-1-ylamino)-propionitrile. With a topological polar surface area (TPSA) of 35.82 Ų, 3-(Adamantan-1-ylamino)-propionitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Adamantan-1-ylamino)-propionitrile has 1 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-(Adamantan-1-ylamino)-propionitrile?
The CAS number of 3-(Adamantan-1-ylamino)-propionitrile is 32901-14-7.
What is the molecular formula of 3-(Adamantan-1-ylamino)-propionitrile?
The molecular formula of 3-(Adamantan-1-ylamino)-propionitrile is C13H20N2.
What is the molecular weight of 3-(Adamantan-1-ylamino)-propionitrile?
The molecular weight of 3-(Adamantan-1-ylamino)-propionitrile is 204.16 g/mol.
Where can I buy 3-(Adamantan-1-ylamino)-propionitrile?
You can request a quote for 3-(Adamantan-1-ylamino)-propionitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Adamantan-1-ylamino)-propionitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(Adamantan-1-ylamino)-propionitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.