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

C13H12ClN3O — CID 140701994

IUPACN-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide
SMILESCc1cc(NC(=O)c2ccccn2)c(Cl)c(C)n1
InChIInChI=1S/C13H12ClN3O/c1-8-7-11(12(14)9(2)16-8)17-13(18)10-5-3-4-6-15-10/h3-7H,1-2H3,(H,16,17,18)
InChIKeyKQLDNNDPLRZVMD-UHFFFAOYSA-N
MW261.71 g/mol
LogP3.00
Rot. Bonds2

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

N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide (PubChem CID 140701994) has the molecular formula C13H12ClN3O and a molecular weight of 261.71 g/mol. Its IUPAC name is N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide
PubChem CID140701994
Molecular FormulaC13H12ClN3O
Molecular Weight261.71 g/mol
Exact Mass261.07
IUPAC NameN-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide
SMILESCc1cc(NC(=O)c2ccccn2)c(Cl)c(C)n1
InChIInChI=1S/C13H12ClN3O/c1-8-7-11(12(14)9(2)16-8)17-13(18)10-5-3-4-6-15-10/h3-7H,1-2H3,(H,16,17,18)
InChIKeyKQLDNNDPLRZVMD-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

N-(6-bromo-2-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 103909689
N-[4-methyl-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 4867706
N-[2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide;ruthenium(2+);dichloride
CID 46845295
N-(2-bromo-5-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 113445582
N-(2-amino-4,5-dimethylphenyl)pyridine-2-carboxamide
CID 55037245
N-(4-amino-5-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 113438955
N-[4,5-dimethoxy-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 102266460
N-(2-amino-4-methylphenyl)pyridine-2-carboxamide
CID 43259115
N-(2-bromo-5-chlorophenyl)pyridine-2-carboxamide
CID 81271946
4-methyl-3-(pyridine-2-carbonylamino)benzoic acid
CID 16771811
propan-2-yl 2-methyl-4-(pyridine-2-carbonylamino)quinoline-6-carboxylate
CID 17016338
N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide
CID 110858745

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide (CID 140701994) is N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide is Cc1cc(NC(=O)c2ccccn2)c(Cl)c(C)n1.
What is the InChIKey of N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide?
The InChIKey is KQLDNNDPLRZVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN3O/c1-8-7-11(12(14)9(2)16-8)17-13(18)10-5-3-4-6-15-10/h3-7H,1-2H3,(H,16,17,18).
What are the key properties of N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide?
N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-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 N-(3-chloro-2,6-dimethyl-4-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 140701994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).