(3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine

C13H13ClN2 — CID 63839417

IUPAC(3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine
SMILESCc1ccnc(C(N)c2cccc(Cl)c2)c1
InChIInChI=1S/C13H13ClN2/c1-9-5-6-16-12(7-9)13(15)10-3-2-4-11(14)8-10/h2-8,13H,15H2,1H3
InChIKeyUVHBESHAGHQFHY-UHFFFAOYSA-N
MW232.71 g/mol
LogP3.09
Rot. Bonds2

About (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine

(3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine (PubChem CID 63839417) has the molecular formula C13H13ClN2 and a molecular weight of 232.71 g/mol. Its IUPAC name is (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine
PubChem CID63839417
Molecular FormulaC13H13ClN2
Molecular Weight232.71 g/mol
Exact Mass232.08
IUPAC Name(3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine
SMILESCc1ccnc(C(N)c2cccc(Cl)c2)c1
InChIInChI=1S/C13H13ClN2/c1-9-5-6-16-12(7-9)13(15)10-3-2-4-11(14)8-10/h2-8,13H,15H2,1H3
InChIKeyUVHBESHAGHQFHY-UHFFFAOYSA-N
XLogP3.09
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-chlorophenyl)-(4-methyl-2-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

Related Compounds

(4-methyl-2-pyridinyl)-phenylmethanamine
CID 571849
(4-methylphenyl)-(4-methyl-2-pyridinyl)methanamine
CID 63840530
(3,4-dimethylphenyl)-(4-methyl-2-pyridinyl)methanamine
CID 55256587
(3-chlorophenyl)-(6-methyl-2-pyridinyl)methanamine
CID 63555430
(4-chloro-3-methoxyphenyl)-(4-methyl-2-pyridinyl)methanamine
CID 79699404
N-[(3-chlorophenyl)-(4-methyl-2-pyridinyl)methyl]propan-1-amine
CID 63840842
(2-chloro-4-methylphenyl)-(3-chlorophenyl)methanamine
CID 106857071
(3-chlorophenyl)-(2-fluoro-5-methylphenyl)methanamine
CID 62789986
(1-methylpyrazol-4-yl)-(4-methyl-2-pyridinyl)methanamine
CID 63839914
(3-chlorophenyl)-(3,5-dichlorophenyl)methanamine
CID 115811895
(2,6-difluoro-3-methylphenyl)-(4-methyl-2-pyridinyl)methanamine
CID 82823215
(3-chlorophenyl)-quinolin-2-ylmethanamine
CID 63222803

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine?
The IUPAC name of (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine (CID 63839417) is (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine?
The canonical SMILES for (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine is Cc1ccnc(C(N)c2cccc(Cl)c2)c1.
What is the InChIKey of (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine?
The InChIKey is UVHBESHAGHQFHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2/c1-9-5-6-16-12(7-9)13(15)10-3-2-4-11(14)8-10/h2-8,13H,15H2,1H3.
What are the key properties of (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine?
(3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine has a molecular weight of 232.71 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-(4-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 63839417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).