N-(2-pyridin-2-ylethyl)pyrimidin-2-amine

C11H12N4 — CID 10081506

IUPACN-(2-pyridin-2-ylethyl)pyrimidin-2-amine
SMILESc1ccc(CCNc2ncccn2)nc1
InChIInChI=1S/C11H12N4/c1-2-6-12-10(4-1)5-9-15-11-13-7-3-8-14-11/h1-4,6-8H,5,9H2,(H,13,14,15)
InChIKeyXXWZXEZYCSRMPC-UHFFFAOYSA-N
MW200.25 g/mol
LogP1.53
Rot. Bonds4

About N-(2-pyridin-2-ylethyl)pyrimidin-2-amine

N-(2-pyridin-2-ylethyl)pyrimidin-2-amine (PubChem CID 10081506) has the molecular formula C11H12N4 and a molecular weight of 200.25 g/mol. Its IUPAC name is N-(2-pyridin-2-ylethyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-(2-pyridin-2-ylethyl)pyrimidin-2-amine
PubChem CID10081506
Molecular FormulaC11H12N4
Molecular Weight200.25 g/mol
Exact Mass200.11
IUPAC NameN-(2-pyridin-2-ylethyl)pyrimidin-2-amine
SMILESc1ccc(CCNc2ncccn2)nc1
InChIInChI=1S/C11H12N4/c1-2-6-12-10(4-1)5-9-15-11-13-7-3-8-14-11/h1-4,6-8H,5,9H2,(H,13,14,15)
InChIKeyXXWZXEZYCSRMPC-UHFFFAOYSA-N
XLogP1.53
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.25
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-pyridin-2-ylethyl)pyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-2-ylethyl)pyrimidin-2-amine?
The IUPAC name of N-(2-pyridin-2-ylethyl)pyrimidin-2-amine (CID 10081506) is N-(2-pyridin-2-ylethyl)pyrimidin-2-amine.
What is the SMILES notation for N-(2-pyridin-2-ylethyl)pyrimidin-2-amine?
The canonical SMILES for N-(2-pyridin-2-ylethyl)pyrimidin-2-amine is c1ccc(CCNc2ncccn2)nc1.
What is the InChIKey of N-(2-pyridin-2-ylethyl)pyrimidin-2-amine?
The InChIKey is XXWZXEZYCSRMPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4/c1-2-6-12-10(4-1)5-9-15-11-13-7-3-8-14-11/h1-4,6-8H,5,9H2,(H,13,14,15).
What are the key properties of N-(2-pyridin-2-ylethyl)pyrimidin-2-amine?
N-(2-pyridin-2-ylethyl)pyrimidin-2-amine has a molecular weight of 200.25 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-2-ylethyl)pyrimidin-2-amine is sourced from PubChem (CID 10081506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).