4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide

C12H9Cl2N3O — CID 81225634

IUPAC4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2ccc(Cl)cn2)cn1
InChIInChI=1S/C12H9Cl2N3O/c1-7-4-10(14)9(6-15-7)12(18)17-11-3-2-8(13)5-16-11/h2-6H,1H3,(H,16,17,18)
InChIKeyOEPKKGOKXRGFQK-UHFFFAOYSA-N
MW282.13 g/mol
LogP3.34
Rot. Bonds2

About 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide

4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide (PubChem CID 81225634) has the molecular formula C12H9Cl2N3O and a molecular weight of 282.13 g/mol. Its IUPAC name is 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide
PubChem CID81225634
Molecular FormulaC12H9Cl2N3O
Molecular Weight282.13 g/mol
Exact Mass281.01
IUPAC Name4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2ccc(Cl)cn2)cn1
InChIInChI=1S/C12H9Cl2N3O/c1-7-4-10(14)9(6-15-7)12(18)17-11-3-2-8(13)5-16-11/h2-6H,1H3,(H,16,17,18)
InChIKeyOEPKKGOKXRGFQK-UHFFFAOYSA-N
XLogP3.34
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.13
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide
CID 81225292
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 81225554
4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide
CID 81225961
4-chloro-N-(4-chloro-3-fluorophenyl)-6-methylpyridine-3-carboxamide
CID 81226487
4-bromo-N-(5-chloro-2-pyridinyl)-6-methylpyridine-2-carboxamide
CID 67164027
N-(5-chloro-2-pyridinyl)-2-methylbenzamide
CID 758009
N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 79770805
N-(5-chloro-2-pyridinyl)-2-hydroxy-5-methylbenzamide
CID 28831587
4-chloro-N-(5-chloro-2-cyanophenyl)-6-methylpyridine-3-carboxamide
CID 81226633
N-(3-acetamidophenyl)-4-chloro-6-methylpyridine-3-carboxamide
CID 81228962
N-(5-chloro-2-pyridinyl)-4-fluoro-2-methylbenzamide
CID 112702466

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide (CID 81225634) is 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide is Cc1cc(Cl)c(C(=O)Nc2ccc(Cl)cn2)cn1.
What is the InChIKey of 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide?
The InChIKey is OEPKKGOKXRGFQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2N3O/c1-7-4-10(14)9(6-15-7)12(18)17-11-3-2-8(13)5-16-11/h2-6H,1H3,(H,16,17,18).
What are the key properties of 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide?
4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide has a molecular weight of 282.13 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81225634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).