[2-(2-chlorophenyl)-4-pyridinyl]methanamine

C12H11ClN2 — CID 83706166

IUPAC[2-(2-chlorophenyl)-4-pyridinyl]methanamine
SMILESNCc1ccnc(-c2ccccc2Cl)c1
InChIInChI=1S/C12H11ClN2/c13-11-4-2-1-3-10(11)12-7-9(8-14)5-6-15-12/h1-7H,8,14H2
InChIKeyPJGGZWLMGDQPKP-UHFFFAOYSA-N
MW218.69 g/mol
LogP2.86
Rot. Bonds2

About [2-(2-chlorophenyl)-4-pyridinyl]methanamine

[2-(2-chlorophenyl)-4-pyridinyl]methanamine (PubChem CID 83706166) has the molecular formula C12H11ClN2 and a molecular weight of 218.69 g/mol. Its IUPAC name is [2-(2-chlorophenyl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(2-chlorophenyl)-4-pyridinyl]methanamine
PubChem CID83706166
Molecular FormulaC12H11ClN2
Molecular Weight218.69 g/mol
Exact Mass218.06
IUPAC Name[2-(2-chlorophenyl)-4-pyridinyl]methanamine
SMILESNCc1ccnc(-c2ccccc2Cl)c1
InChIInChI=1S/C12H11ClN2/c13-11-4-2-1-3-10(11)12-7-9(8-14)5-6-15-12/h1-7H,8,14H2
InChIKeyPJGGZWLMGDQPKP-UHFFFAOYSA-N
XLogP2.86
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.69
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(2-chlorophenyl)-4-pyridinyl]methanamine 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 [2-(2-chlorophenyl)-4-pyridinyl]methanamine?
The IUPAC name of [2-(2-chlorophenyl)-4-pyridinyl]methanamine (CID 83706166) is [2-(2-chlorophenyl)-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(2-chlorophenyl)-4-pyridinyl]methanamine?
The canonical SMILES for [2-(2-chlorophenyl)-4-pyridinyl]methanamine is NCc1ccnc(-c2ccccc2Cl)c1.
What is the InChIKey of [2-(2-chlorophenyl)-4-pyridinyl]methanamine?
The InChIKey is PJGGZWLMGDQPKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2/c13-11-4-2-1-3-10(11)12-7-9(8-14)5-6-15-12/h1-7H,8,14H2.
What are the key properties of [2-(2-chlorophenyl)-4-pyridinyl]methanamine?
[2-(2-chlorophenyl)-4-pyridinyl]methanamine has a molecular weight of 218.69 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chlorophenyl)-4-pyridinyl]methanamine is sourced from PubChem (CID 83706166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).