N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide

C20H22ClN3O2 — CID 109090311

IUPACN-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cc(C(=O)N2CCCC(C)C2)ccn1
InChIInChI=1S/C20H22ClN3O2/c1-13-4-3-9-24(12-13)20(26)15-7-8-22-18(11-15)19(25)23-17-6-5-16(21)10-14(17)2/h5-8,10-11,13H,3-4,9,12H2,1-2H3,(H,23,25)
InChIKeyWNFRLRGCGVANPL-UHFFFAOYSA-N
MW371.87 g/mol
LogP4.17
Rot. Bonds3

About N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide

N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109090311) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
PubChem CID109090311
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC NameN-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1cc(C(=O)N2CCCC(C)C2)ccn1
InChIInChI=1S/C20H22ClN3O2/c1-13-4-3-9-24(12-13)20(26)15-7-8-22-18(11-15)19(25)23-17-6-5-16(21)10-14(17)2/h5-8,10-11,13H,3-4,9,12H2,1-2H3,(H,23,25)
InChIKeyWNFRLRGCGVANPL-UHFFFAOYSA-N
XLogP4.17
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
CID 109048988
N-(5-chloro-2-methoxyphenyl)-2-(3-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090402
2-(3-methylpiperidine-1-carbonyl)-N-(2,3,4-trifluorophenyl)pyridine-4-carboxamide
CID 109090445
N-cyclopentyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109080925
4-N-(4-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080960
N-(2,5-dimethylphenyl)-2-(3-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090374
4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxylic acid
CID 112700608
2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide
CID 109078521
N-cycloheptyl-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109089437
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090343
N-(2,4-difluorophenyl)-2-(3-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090432
4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide
CID 109081597

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide (CID 109090311) is N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide is Cc1cc(Cl)ccc1NC(=O)c1cc(C(=O)N2CCCC(C)C2)ccn1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is WNFRLRGCGVANPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c1-13-4-3-9-24(12-13)20(26)15-7-8-22-18(11-15)19(25)23-17-6-5-16(21)10-14(17)2/h5-8,10-11,13H,3-4,9,12H2,1-2H3,(H,23,25).
What are the key properties of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide?
N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 371.87 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109090311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).