N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide

C16H23N3O3 — CID 118775630

IUPACN-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
SMILESCC(=O)N1CCC(CNC(=O)c2cn(C)c(C)cc2=O)CC1
InChIInChI=1S/C16H23N3O3/c1-11-8-15(21)14(10-18(11)3)16(22)17-9-13-4-6-19(7-5-13)12(2)20/h8,10,13H,4-7,9H2,1-3H3,(H,17,22)
InChIKeyJCGUGUMHECYTIQ-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.68
Rot. Bonds3

About N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide

N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide (PubChem CID 118775630) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
PubChem CID118775630
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
SMILESCC(=O)N1CCC(CNC(=O)c2cn(C)c(C)cc2=O)CC1
InChIInChI=1S/C16H23N3O3/c1-11-8-15(21)14(10-18(11)3)16(22)17-9-13-4-6-19(7-5-13)12(2)20/h8,10,13H,4-7,9H2,1-3H3,(H,17,22)
InChIKeyJCGUGUMHECYTIQ-UHFFFAOYSA-N
XLogP0.68
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-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-[(1-acetylpiperidin-4-yl)methyl]-2-methylbenzamide
CID 110736135
N-[(1-acetylpiperidin-4-yl)methyl]-2,3,4-trifluorobenzamide
CID 110736173
N-[(1-acetylpiperidin-4-yl)methyl]-2-aminobenzamide;hydrochloride
CID 119945298
N-[(1-acetylpiperidin-4-yl)methyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 110745949
4-[[(2,5-dimethyl-1H-pyrrole-3-carbonyl)amino]methyl]piperidine-1-carboxylic acid
CID 90695043
1,6-dimethyl-N-[(3R)-1-(2-methylpropanoyl)piperidin-3-yl]-4-oxopyridine-3-carboxamide
CID 126427357
1,6-dimethyl-N-[(2S)-1-morpholin-4-ylpropan-2-yl]-4-oxopyridine-3-carboxamide
CID 126449276
N-[(1-acetylpiperidin-4-yl)methyl]-3-methoxybenzamide
CID 110736146
N-[(1-acetylpiperidin-4-yl)methyl]-2-(4-methylphenoxy)acetamide
CID 110736170
6-bromo-N-(cyclopropylmethyl)-1-methylindole-3-carboxamide
CID 172654835
N-[(1-acetylpiperidin-4-yl)methyl]-3-amino-5-chloro-2-methanimidoylbenzamide
CID 121325886
5-amino-2-methyl-N-[[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]methyl]benzamide;hydrochloride
CID 120636550

Frequently Asked Questions

What is the IUPAC name of N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
The IUPAC name of N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide (CID 118775630) is N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
The canonical SMILES for N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide is CC(=O)N1CCC(CNC(=O)c2cn(C)c(C)cc2=O)CC1.
What is the InChIKey of N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
The InChIKey is JCGUGUMHECYTIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-11-8-15(21)14(10-18(11)3)16(22)17-9-13-4-6-19(7-5-13)12(2)20/h8,10,13H,4-7,9H2,1-3H3,(H,17,22).
What are the key properties of N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide?
N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-acetylpiperidin-4-yl)methyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 118775630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).