1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one

C23H29N5O3 — CID 92632753

IUPAC1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one
SMILESCc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)cn1
InChIInChI=1S/C23H29N5O3/c1-16-13-25-19(14-24-16)23(31)28-10-4-3-5-20(28)17-8-11-27(12-9-17)22(30)18-6-7-21(29)26(2)15-18/h6-7,13-15,17,20H,3-5,8-12H2,1-2H3/t20-/m1/s1
InChIKeyVKAJXUMQIJBOHM-HXUWFJFHSA-N
MW423.52 g/mol
LogP2.03
Rot. Bonds3

About 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one

1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one (PubChem CID 92632753) has the molecular formula C23H29N5O3 and a molecular weight of 423.52 g/mol. Its IUPAC name is 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one
PubChem CID92632753
Molecular FormulaC23H29N5O3
Molecular Weight423.52 g/mol
Exact Mass423.23
IUPAC Name1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one
SMILESCc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)cn1
InChIInChI=1S/C23H29N5O3/c1-16-13-25-19(14-24-16)23(31)28-10-4-3-5-20(28)17-8-11-27(12-9-17)22(30)18-6-7-21(29)26(2)15-18/h6-7,13-15,17,20H,3-5,8-12H2,1-2H3/t20-/m1/s1
InChIKeyVKAJXUMQIJBOHM-HXUWFJFHSA-N
XLogP2.03
TPSA88.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.52
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]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

[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidin-1-yl]-(thiadiazol-4-yl)methanone
CID 92632709
1-methyl-5-[(4S)-4-methylazepane-1-carbonyl]pyridin-2-one
CID 95591235
1-methyl-5-[4-[(1R)-1-pyrrolidin-1-ylethyl]piperidine-1-carbonyl]pyridin-2-one
CID 95873949
1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one
CID 127339699
cyclopentyl-[4-(5-methylpyrazine-2-carbonyl)piperazin-1-yl]methanone
CID 38390846
(8aR,11aS)-1-(5-methylpyrazine-2-carbonyl)-3,4,5,6,7,8a,9,10,11,11a-decahydro-2H-cyclopenta[b][1,5]diazecin-8-one
CID 110201552
1-(5-methylpyrazine-2-carbonyl)azepane-2-carboxylic acid
CID 64561466
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-[5-(methylamino)-2-pyridinyl]methanone
CID 104641595
1-[(2S,3aR,8aS)-4-(5-methylpyrazine-2-carbonyl)-2-phenyl-2,3,3a,5,6,7,8,8a-octahydropyrrolo[3,2-b]azepin-1-yl]ethanone
CID 110138103
1-(5-methylpyrazine-2-carbonyl)piperidine-2-carbonitrile
CID 114031881
5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine-1-carbonyl)pyrazine-2-carboxylic acid
CID 120689002
(3S,5S)-N-(4-fluorophenyl)-1-methyl-5-[1-(5-methylpyrazine-2-carbonyl)piperidin-4-yl]pyrrolidine-3-carboxamide
CID 93240243

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one?
The IUPAC name of 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one (CID 92632753) is 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one.
What is the SMILES notation for 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one?
The canonical SMILES for 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one is Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)cn1.
What is the InChIKey of 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one?
The InChIKey is VKAJXUMQIJBOHM-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H29N5O3/c1-16-13-25-19(14-24-16)23(31)28-10-4-3-5-20(28)17-8-11-27(12-9-17)22(30)18-6-7-21(29)26(2)15-18/h6-7,13-15,17,20H,3-5,8-12H2,1-2H3/t20-/m1/s1.
What are the key properties of 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one?
1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one has a molecular weight of 423.52 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[4-[(2R)-1-(5-methylpyrazine-2-carbonyl)piperidin-2-yl]piperidine-1-carbonyl]pyridin-2-one is sourced from PubChem (CID 92632753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).