6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine

C12H10Cl2N2 — CID 63585961

IUPAC6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
SMILESCc1ccc(Nc2cccc(Cl)n2)cc1Cl
InChIInChI=1S/C12H10Cl2N2/c1-8-5-6-9(7-10(8)13)15-12-4-2-3-11(14)16-12/h2-7H,1H3,(H,15,16)
InChIKeyRCWOBYGVPXYTTI-UHFFFAOYSA-N
MW253.13 g/mol
LogP4.44
Rot. Bonds2

About 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine

6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine (PubChem CID 63585961) has the molecular formula C12H10Cl2N2 and a molecular weight of 253.13 g/mol. Its IUPAC name is 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
PubChem CID63585961
Molecular FormulaC12H10Cl2N2
Molecular Weight253.13 g/mol
Exact Mass252.02
IUPAC Name6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
SMILESCc1ccc(Nc2cccc(Cl)n2)cc1Cl
InChIInChI=1S/C12H10Cl2N2/c1-8-5-6-9(7-10(8)13)15-12-4-2-3-11(14)16-12/h2-7H,1H3,(H,15,16)
InChIKeyRCWOBYGVPXYTTI-UHFFFAOYSA-N
XLogP4.44
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.13
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridin-2-amine
CID 63588805
2-chloro-6-(3-chloro-4-methylanilino)pyridine-4-carboxylic acid
CID 43343601
6-chloro-N-(4,5-dichloro-2-methylphenyl)pyridin-2-amine;ethane
CID 144720384
2-N-(3-chloro-4-methylphenyl)-4-N-(3-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
CID 112930113
6-chloro-N-(4-fluorophenyl)pyridin-2-amine;2,6-dichloropyridine
CID 160664212
6-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridin-2-amine
CID 60727080
N-(3,4-dichlorophenyl)-6-hydrazinylpyridin-2-amine
CID 80926061
6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine
CID 80755260
4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine
CID 83152094
1-[3-[[2-(3-chloro-4-methylanilino)pyrimidin-4-yl]amino]phenyl]ethanone
CID 112904094
3-[(6-chloro-2-pyridinyl)amino]-4-methylbenzonitrile
CID 55213185
6-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridin-2-amine
CID 55027599

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine (CID 63585961) is 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine is Cc1ccc(Nc2cccc(Cl)n2)cc1Cl.
What is the InChIKey of 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine?
The InChIKey is RCWOBYGVPXYTTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2/c1-8-5-6-9(7-10(8)13)15-12-4-2-3-11(14)16-12/h2-7H,1H3,(H,15,16).
What are the key properties of 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine?
6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine has a molecular weight of 253.13 g/mol, XLogP of 4.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine is sourced from PubChem (CID 63585961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).