5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one

C24H24N2O3 — CID 25305199

IUPAC5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCc1cc(C(=O)N2CCC[C@H](C(=O)c3cccc4ccccc34)C2)c(=O)[nH]c1C
InChIInChI=1S/C24H24N2O3/c1-15-13-21(23(28)25-16(15)2)24(29)26-12-6-9-18(14-26)22(27)20-11-5-8-17-7-3-4-10-19(17)20/h3-5,7-8,10-11,13,18H,6,9,12,14H2,1-2H3,(H,25,28)/t18-/m0/s1
InChIKeyMPTWSOPVDFUFKT-SFHVURJKSA-N
MW388.47 g/mol
LogP3.88
Rot. Bonds3

About 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one

5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 25305199) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID25305199
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCc1cc(C(=O)N2CCC[C@H](C(=O)c3cccc4ccccc34)C2)c(=O)[nH]c1C
InChIInChI=1S/C24H24N2O3/c1-15-13-21(23(28)25-16(15)2)24(29)26-12-6-9-18(14-26)22(27)20-11-5-8-17-7-3-4-10-19(17)20/h3-5,7-8,10-11,13,18H,6,9,12,14H2,1-2H3,(H,25,28)/t18-/m0/s1
InChIKeyMPTWSOPVDFUFKT-SFHVURJKSA-N
XLogP3.88
TPSA70.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-naphthalen-1-ylmethanone
CID 95728859
5,6-dimethyl-3-[(3S)-3-(4-phenoxybenzoyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 25455356
[1-(3-methylbenzoyl)piperidin-3-yl]-naphthalen-1-ylmethanone
CID 45202126
[(3S)-1-(6-methylquinoline-4-carbonyl)piperidin-3-yl]-naphthalen-1-ylmethanone
CID 42215892
(3R)-1-(naphthalene-1-carbonyl)piperidine-3-carboxylic acid
CID 7131658
3-methyl-1-[(3R)-3-(naphthalene-1-carbonyl)piperidin-1-yl]but-2-en-1-one
CID 25372306
(3-methylpiperidin-1-yl)-naphthalen-1-ylmethanone
CID 4284306
5,6-dimethyl-3-[(3S)-3-(pyridin-3-ylmethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 124960914
[(3R)-1-(6-methoxy-1-methylindole-2-carbonyl)piperidin-3-yl]-naphthalen-1-ylmethanone
CID 25289588
(6R)-1-(5,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)-4-methyl-1,4-diazepane-6-carboxamide
CID 124970408
[(3S)-1-cyclobutylpiperidin-3-yl]-naphthalen-1-ylmethanone
CID 42357685
(3R)-N-ethoxy-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide
CID 31099034

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one (CID 25305199) is 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one is Cc1cc(C(=O)N2CCC[C@H](C(=O)c3cccc4ccccc34)C2)c(=O)[nH]c1C.
What is the InChIKey of 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is MPTWSOPVDFUFKT-SFHVURJKSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-15-13-21(23(28)25-16(15)2)24(29)26-12-6-9-18(14-26)22(27)20-11-5-8-17-7-3-4-10-19(17)20/h3-5,7-8,10-11,13,18H,6,9,12,14H2,1-2H3,(H,25,28)/t18-/m0/s1.
What are the key properties of 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one?
5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 388.47 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-3-[(3S)-3-(naphthalene-1-carbonyl)piperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 25305199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).