4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one

C17H22N4O2 — CID 97123718

IUPAC4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCc1cc(C)c(C(=O)N2CCCC[C@@H]2c2ccn(C)n2)c(=O)[nH]1
InChIInChI=1S/C17H22N4O2/c1-11-10-12(2)18-16(22)15(11)17(23)21-8-5-4-6-14(21)13-7-9-20(3)19-13/h7,9-10,14H,4-6,8H2,1-3H3,(H,18,22)/t14-/m1/s1
InChIKeyINRJXSZUEWDLNS-CQSZACIVSA-N
MW314.39 g/mol
LogP2.09
Rot. Bonds2

About 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one

4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 97123718) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID97123718
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCc1cc(C)c(C(=O)N2CCCC[C@@H]2c2ccn(C)n2)c(=O)[nH]1
InChIInChI=1S/C17H22N4O2/c1-11-10-12(2)18-16(22)15(11)17(23)21-8-5-4-6-14(21)13-7-9-20(3)19-13/h7,9-10,14H,4-6,8H2,1-3H3,(H,18,22)/t14-/m1/s1
InChIKeyINRJXSZUEWDLNS-CQSZACIVSA-N
XLogP2.09
TPSA70.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one 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

[(2S)-2-(1-methylpyrazol-3-yl)piperidin-1-yl]-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]methanone
CID 97123063
[2-(1-methylpyrazol-3-yl)azepan-1-yl]-pyridin-3-ylmethanone
CID 110225788
(6-methoxy-3-methyl-1-benzofuran-2-yl)-[(2R)-2-(1-methylpyrazol-3-yl)piperidin-1-yl]methanone
CID 97132095
imidazo[2,1-b][1,3]thiazol-6-yl-[2-(1-methylpyrazol-3-yl)piperidin-1-yl]methanone
CID 70754166
1-adamantyl-[2-(1-methylpyrazol-3-yl)azepan-1-yl]methanone
CID 46960202
1-adamantyl-[(2R)-2-(1-methylpyrazol-3-yl)azepan-1-yl]methanone
CID 51588018
(1-methylpyrazol-3-yl)-[(2R)-2-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone
CID 95824417
1-[2-(1-methylpyrazol-3-yl)piperidin-1-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-one
CID 70729927
[5-cyclopropyl-7-(difluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-[2-(1-methylpyrazol-3-yl)azepan-1-yl]methanone
CID 46952817
8-methyl-3-[[2-(1-methylpyrazol-3-yl)piperidin-1-yl]methyl]-1H-quinolin-2-one
CID 56752979
8-methyl-3-[[(2S)-2-(1-methylpyrazol-3-yl)piperidin-1-yl]methyl]-1H-quinolin-2-one
CID 95211886
[(2R)-2-(1H-benzimidazol-2-yl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 124986227

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one (CID 97123718) is 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one is Cc1cc(C)c(C(=O)N2CCCC[C@@H]2c2ccn(C)n2)c(=O)[nH]1.
What is the InChIKey of 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is INRJXSZUEWDLNS-CQSZACIVSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-11-10-12(2)18-16(22)15(11)17(23)21-8-5-4-6-14(21)13-7-9-20(3)19-13/h7,9-10,14H,4-6,8H2,1-3H3,(H,18,22)/t14-/m1/s1.
What are the key properties of 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one?
4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 314.39 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-3-[(2R)-2-(1-methylpyrazol-3-yl)piperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 97123718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).