4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide

C13H12ClN3O — CID 81225554

IUPAC4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2cccc(C)n2)cn1
InChIInChI=1S/C13H12ClN3O/c1-8-4-3-5-12(16-8)17-13(18)10-7-15-9(2)6-11(10)14/h3-7H,1-2H3,(H,16,17,18)
InChIKeyJDKGRGZSOWXXRB-UHFFFAOYSA-N
MW261.71 g/mol
LogP3.00
Rot. Bonds2

About 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide

4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide (PubChem CID 81225554) has the molecular formula C13H12ClN3O and a molecular weight of 261.71 g/mol. Its IUPAC name is 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
PubChem CID81225554
Molecular FormulaC13H12ClN3O
Molecular Weight261.71 g/mol
Exact Mass261.07
IUPAC Name4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2cccc(C)n2)cn1
InChIInChI=1S/C13H12ClN3O/c1-8-4-3-5-12(16-8)17-13(18)10-7-15-9(2)6-11(10)14/h3-7H,1-2H3,(H,16,17,18)
InChIKeyJDKGRGZSOWXXRB-UHFFFAOYSA-N
XLogP3.00
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.71
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide
CID 81225634
4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide
CID 81225292
2-chloro-5-iodo-N-(6-methyl-2-pyridinyl)benzamide
CID 1347930
N-(3-acetamidophenyl)-4-chloro-6-methylpyridine-3-carboxamide
CID 81228962
5-chloro-2-[(6-methyl-2-pyridinyl)carbamoyl]benzoic acid
CID 72947279
5-amino-2-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 54917395
4-chloro-6-methyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide
CID 81225795
propan-2-yl 4,5-dichloro-2-[(6-methyl-2-pyridinyl)carbamoyl]benzoate
CID 90303117
tert-butyl 4,5-dichloro-2-[(6-methyl-2-pyridinyl)carbamoyl]benzoate
CID 90303364
4-chloro-6-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-carboxamide
CID 103803878
3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 115645542
4-chloro-6-methyl-N-quinolin-5-ylpyridine-3-carboxamide
CID 81230952

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide (CID 81225554) is 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide is Cc1cc(Cl)c(C(=O)Nc2cccc(C)n2)cn1.
What is the InChIKey of 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide?
The InChIKey is JDKGRGZSOWXXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O/c1-8-4-3-5-12(16-8)17-13(18)10-7-15-9(2)6-11(10)14/h3-7H,1-2H3,(H,16,17,18).
What are the key properties of 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide?
4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide has a molecular weight of 261.71 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 81225554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).