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

C20H22ClN3O2 — CID 109081888

IUPACN-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
SMILESCc1c(Cl)cccc1NC(=O)c1ccnc(C(=O)N2CCC(C)CC2)c1
InChIInChI=1S/C20H22ClN3O2/c1-13-7-10-24(11-8-13)20(26)18-12-15(6-9-22-18)19(25)23-17-5-3-4-16(21)14(17)2/h3-6,9,12-13H,7-8,10-11H2,1-2H3,(H,23,25)
InChIKeyLWEIYAJYONEBNQ-UHFFFAOYSA-N
MW371.87 g/mol
LogP4.17
Rot. Bonds3

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

N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide (PubChem CID 109081888) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
PubChem CID109081888
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
SMILESCc1c(Cl)cccc1NC(=O)c1ccnc(C(=O)N2CCC(C)CC2)c1
InChIInChI=1S/C20H22ClN3O2/c1-13-7-10-24(11-8-13)20(26)18-12-15(6-9-22-18)19(25)23-17-5-3-4-16(21)14(17)2/h3-6,9,12-13H,7-8,10-11H2,1-2H3,(H,23,25)
InChIKeyLWEIYAJYONEBNQ-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

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,6-dichlorophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081931
N-(3-chloro-2-methylphenyl)-4-(4-ethylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109084484
N-(3-cyanophenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081935
N-cyclopentyl-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109080690
N-(4-methoxyphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081898
4-N-tert-butyl-2-N-(3-chloro-2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109089161
4-N-(3-chloro-2-methylphenyl)-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109092904
N-benzyl-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081809
4-N-(2-chlorophenyl)-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092151
N-(3-chloro-2-methylphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203910
N-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080420
2-(azepane-1-carbonyl)-N-(2,5-dichlorophenyl)pyridine-4-carboxamide
CID 109090794

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide (CID 109081888) is N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide is Cc1c(Cl)cccc1NC(=O)c1ccnc(C(=O)N2CCC(C)CC2)c1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
The InChIKey is LWEIYAJYONEBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c1-13-7-10-24(11-8-13)20(26)18-12-15(6-9-22-18)19(25)23-17-5-3-4-16(21)14(17)2/h3-6,9,12-13H,7-8,10-11H2,1-2H3,(H,23,25).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide?
N-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-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-(3-chloro-2-methylphenyl)-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide is sourced from PubChem (CID 109081888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).