(2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone

C12H7Cl2NO — CID 103443193

IUPAC(2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone
SMILESO=C(c1ccccc1Cl)c1ncccc1Cl
InChIInChI=1S/C12H7Cl2NO/c13-9-5-2-1-4-8(9)12(16)11-10(14)6-3-7-15-11/h1-7H
InChIKeyWZAQVYBDHQMCHJ-UHFFFAOYSA-N
MW252.10 g/mol
LogP3.62
Rot. Bonds2

About (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone

(2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone (PubChem CID 103443193) has the molecular formula C12H7Cl2NO and a molecular weight of 252.10 g/mol. Its IUPAC name is (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone
PubChem CID103443193
Molecular FormulaC12H7Cl2NO
Molecular Weight252.10 g/mol
Exact Mass250.99
IUPAC Name(2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone
SMILESO=C(c1ccccc1Cl)c1ncccc1Cl
InChIInChI=1S/C12H7Cl2NO/c13-9-5-2-1-4-8(9)12(16)11-10(14)6-3-7-15-11/h1-7H
InChIKeyWZAQVYBDHQMCHJ-UHFFFAOYSA-N
XLogP3.62
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.10
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3-chloro-2-pyridinyl)-[2-(2-methoxyethoxy)phenyl]methanone
CID 103443277
3-chloropyridine-2-carbonyl chloride
CID 45081497
(3-chloro-2-pyridinyl)-(2-methoxy-5-methylphenyl)methanone
CID 103443137
(3-chloro-2-pyridinyl)-thiophen-2-ylmethanone
CID 103443291
(3-chloro-2-pyridinyl)-(3-chlorothiophen-2-yl)methanone
CID 107359480
(3-chloro-2-pyridinyl)-(3,5-dimethylphenyl)methanone
CID 103443191
1-(3-chloro-2-pyridinyl)propan-1-one
CID 67986834
(3-chloro-2-pyridinyl)-(1,2-thiazol-4-yl)methanone
CID 164647361
(2-chlorophenyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 43339358
(3-chloro-2-pyridinyl)-(5-methyl-3-pyridinyl)methanone
CID 103443112
(2-chlorophenyl)-[2-(2-pyridin-4-ylethynyl)-3-pyridinyl]methanone
CID 69154130
(5-bromo-3-methyltriazol-4-yl)-(3-chloro-2-pyridinyl)methanone
CID 106461754

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone?
The IUPAC name of (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone (CID 103443193) is (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone.
What is the SMILES notation for (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone?
The canonical SMILES for (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone is O=C(c1ccccc1Cl)c1ncccc1Cl.
What is the InChIKey of (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone?
The InChIKey is WZAQVYBDHQMCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2NO/c13-9-5-2-1-4-8(9)12(16)11-10(14)6-3-7-15-11/h1-7H.
What are the key properties of (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone?
(2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone has a molecular weight of 252.10 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(3-chloro-2-pyridinyl)methanone is sourced from PubChem (CID 103443193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).