N-allyl-N-(2-pyrimidinyl)amine
TL;DR: N-allyl-N-(2-pyrimidinyl)amine (CAS 5176-93-2) is a chemical compound with molecular formula C7H9N3 and molecular weight 135.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-prop-2-enylpyrimidin-2-amine
Also Known As: N-Allylpyrimidin-2-amine, N-allyl-N-(2-pyrimidinyl)amine, N-prop-2-enylpyrimidin-2-amine, N-(prop-2-en-1-yl)pyrimidin-2-amine, 2-(Allylamino)pyrimidine
| Molecular Formula | C7H9N3 |
|---|---|
| Molecular Weight | 135.08 g/mol |
| LogP | 1.0745 |
| Topological Polar Surface Area | 37.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 135.07965 |
| Heavy Atoms | 10 |
| Complexity | 195.266 |
Chemical Identifiers
| CAS Number | 5176-93-2 |
|---|---|
| SMILES | C=CCNC1=NC=CC=N1 |
Product Overview
N-allyl-N-(2-pyrimidinyl)amine (CAS 5176-93-2), with molecular formula C7H9N3 and molecular weight 135.08 g/mol. IUPAC: N-prop-2-enylpyrimidin-2-amine.
Chemical Property Profile of N-allyl-N-(2-pyrimidinyl)amine
Property Insights of N-allyl-N-(2-pyrimidinyl)amine
The XLogP value of 1.0745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allyl-N-(2-pyrimidinyl)amine. With a topological polar surface area (TPSA) of 37.81 Ų, N-allyl-N-(2-pyrimidinyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-N-(2-pyrimidinyl)amine has 1 hydrogen bond donor(s) and 3 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 N-allyl-N-(2-pyrimidinyl)amine?
The CAS number of N-allyl-N-(2-pyrimidinyl)amine is 5176-93-2.
What is the molecular formula of N-allyl-N-(2-pyrimidinyl)amine?
The molecular formula of N-allyl-N-(2-pyrimidinyl)amine is C7H9N3.
What is the molecular weight of N-allyl-N-(2-pyrimidinyl)amine?
The molecular weight of N-allyl-N-(2-pyrimidinyl)amine is 135.08 g/mol.
Where can I buy N-allyl-N-(2-pyrimidinyl)amine?
You can request a quote for N-allyl-N-(2-pyrimidinyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-N-(2-pyrimidinyl)amine?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-N-(2-pyrimidinyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.