[4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine

C18H14Cl2N2 — CID 134228110

IUPAC[4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine
SMILESNCc1cc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)cn1
InChIInChI=1S/C18H14Cl2N2/c19-14-5-1-12(2-6-14)17-9-16(10-21)22-11-18(17)13-3-7-15(20)8-4-13/h1-9,11H,10,21H2
InChIKeyVLXSRCVLNCSYPJ-UHFFFAOYSA-N
MW329.23 g/mol
LogP5.18
Rot. Bonds3

About [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine

[4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine (PubChem CID 134228110) has the molecular formula C18H14Cl2N2 and a molecular weight of 329.23 g/mol. Its IUPAC name is [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine
PubChem CID134228110
Molecular FormulaC18H14Cl2N2
Molecular Weight329.23 g/mol
Exact Mass328.05
IUPAC Name[4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine
SMILESNCc1cc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)cn1
InChIInChI=1S/C18H14Cl2N2/c19-14-5-1-12(2-6-14)17-9-16(10-21)22-11-18(17)13-3-7-15(20)8-4-13/h1-9,11H,10,21H2
InChIKeyVLXSRCVLNCSYPJ-UHFFFAOYSA-N
XLogP5.18
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.23
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [4,5-bis(4-chlorophenyl)-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

[4,5-bis(4-chlorophenyl)pyrimidin-2-yl]methanamine
CID 134228140
5-(4-chlorophenyl)-4-ethylpyridin-2-amine
CID 58709677
5-(4-chlorophenyl)-6-methylpyridin-3-amine
CID 165369043
2-[[4,5-bis(4-chlorophenyl)-2-pyridinyl]methyl]-1-thiophen-2-ylsulfonylguanidine
CID 134227739
(4-chloro-2-pyridinyl)methanamine
CID 22727148
5,6-bis(4-chlorophenyl)pyridin-3-amine
CID 174766638
5-(4-chlorophenyl)-6-ethylpyridin-2-amine
CID 58709674
2-[6-(4-chlorophenyl)pyrimidin-4-yl]ethanamine
CID 83850617
2-[2-(4-chlorophenyl)-1H-imidazol-5-yl]ethanamine;dihydrochloride
CID 131880085
5-(4-chlorophenyl)-2-propylpyrimidin-4-amine
CID 62899231
[2-(4-chlorophenyl)-4,5-dimethoxyphenyl]methanamine
CID 54911492
3-[2-(4-chlorophenyl)-1H-imidazol-5-yl]propan-1-amine
CID 82463546

Frequently Asked Questions

What is the IUPAC name of [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine?
The IUPAC name of [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine (CID 134228110) is [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine.
What is the SMILES notation for [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine?
The canonical SMILES for [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine is NCc1cc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)cn1.
What is the InChIKey of [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine?
The InChIKey is VLXSRCVLNCSYPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2/c19-14-5-1-12(2-6-14)17-9-16(10-21)22-11-18(17)13-3-7-15(20)8-4-13/h1-9,11H,10,21H2.
What are the key properties of [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine?
[4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine has a molecular weight of 329.23 g/mol, XLogP of 5.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine is sourced from PubChem (CID 134228110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).