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

C15H15ClN2O3 — CID 18149498

IUPACN-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide
SMILESCOc1cc(Cl)c(NC(=O)c2ccc(C)nc2)cc1OC
InChIInChI=1S/C15H15ClN2O3/c1-9-4-5-10(8-17-9)15(19)18-12-7-14(21-3)13(20-2)6-11(12)16/h4-8H,1-3H3,(H,18,19)
InChIKeyAJJZADAGRZIRPS-UHFFFAOYSA-N
MW306.75 g/mol
LogP3.31
Rot. Bonds4

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

N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide (PubChem CID 18149498) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide
PubChem CID18149498
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC NameN-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide
SMILESCOc1cc(Cl)c(NC(=O)c2ccc(C)nc2)cc1OC
InChIInChI=1S/C15H15ClN2O3/c1-9-4-5-10(8-17-9)15(19)18-12-7-14(21-3)13(20-2)6-11(12)16/h4-8H,1-3H3,(H,18,19)
InChIKeyAJJZADAGRZIRPS-UHFFFAOYSA-N
XLogP3.31
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18149046
N-(3-chloro-4-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18150443
N-(2-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18148000
N-(2-chloro-4,5-dimethoxyphenyl)quinoxaline-6-carboxamide
CID 17443015
N-(6-chloro-1,3-benzodioxol-5-yl)-6-methylpyridine-3-carboxamide
CID 18158591
N-(2-chloro-4,5-dimethoxyphenyl)-2-fluoropyridine-4-carboxamide
CID 61294193
N-(2-methoxy-5-nitrophenyl)-6-methylpyridine-3-carboxamide
CID 46511382
5-bromo-N-(2-chloro-4,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 62954749
N-(2,5-dichloro-4-methoxyphenyl)pyridine-3-carboxamide;hydrochloride
CID 110777674
N-(2-chloro-4-cyanophenyl)-6-methylpyridine-3-carboxamide
CID 103799813
N-(4-chloro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 18148116
N-(2-chloro-4,5-dimethoxyphenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 60709422

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide (CID 18149498) is N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide is COc1cc(Cl)c(NC(=O)c2ccc(C)nc2)cc1OC.
What is the InChIKey of N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is AJJZADAGRZIRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c1-9-4-5-10(8-17-9)15(19)18-12-7-14(21-3)13(20-2)6-11(12)16/h4-8H,1-3H3,(H,18,19).
What are the key properties of N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide?
N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 306.75 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4,5-dimethoxyphenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 18149498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).