1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one

C20H24N2O2 — CID 97084725

IUPAC1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one
SMILESCn1cc(C(=O)N2CCCC[C@@H]2CCc2ccccc2)ccc1=O
InChIInChI=1S/C20H24N2O2/c1-21-15-17(11-13-19(21)23)20(24)22-14-6-5-9-18(22)12-10-16-7-3-2-4-8-16/h2-4,7-8,11,13,15,18H,5-6,9-10,12,14H2,1H3/t18-/m1/s1
InChIKeyBBSKSZPXFYJKRL-GOSISDBHSA-N
MW324.42 g/mol
LogP3.01
Rot. Bonds4

About 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one

1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one (PubChem CID 97084725) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one
PubChem CID97084725
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one
SMILESCn1cc(C(=O)N2CCCC[C@@H]2CCc2ccccc2)ccc1=O
InChIInChI=1S/C20H24N2O2/c1-21-15-17(11-13-19(21)23)20(24)22-14-6-5-9-18(22)12-10-16-7-3-2-4-8-16/h2-4,7-8,11,13,15,18H,5-6,9-10,12,14H2,1H3/t18-/m1/s1
InChIKeyBBSKSZPXFYJKRL-GOSISDBHSA-N
XLogP3.01
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-[(2S)-2-(2-phenylethyl)pyrrolidine-1-carbonyl]pyridin-2-one
CID 94616102
(1-methylpyrrol-2-yl)-[(2S)-2-(2-phenylethyl)piperidin-1-yl]methanone
CID 97084722
[(2S)-2-(2-phenylethyl)piperidin-1-yl]-[4-(1,2,4-triazol-4-yl)phenyl]methanone
CID 96576779
(4-chloro-1-methylpyrazol-3-yl)-[(2R)-2-(2-phenylethyl)piperidin-1-yl]methanone
CID 97119632
5-[2-(2-phenylethyl)pyrrolidine-1-carbonyl]-1,3-dihydrobenzimidazol-2-one
CID 136578028
(3R)-1-(1-methyl-6-oxopyridine-3-carbonyl)-N-(2-phenylethyl)pyrrolidine-3-carboxamide
CID 92633580
[(2S)-2-(2-phenylethyl)piperidin-1-yl]-[3-(1,2,4-triazol-4-yl)phenyl]methanone
CID 96579588
phenyl-(2-propylpiperidin-1-yl)methanone
CID 16637839
[2-(2-phenylethyl)piperidin-1-yl]-pyridazin-3-ylmethanone
CID 70764538
[(2R)-2-[2-(4-hydroxyphenyl)ethyl]piperidin-1-yl]-(1-methylpyrazol-4-yl)methanone
CID 97139701
2-methoxyethyl (2R)-2-(2-phenylethyl)piperidine-1-carboxylate
CID 95724358
phenyl-[(2S)-2-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]methanone
CID 29348343

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one?
The IUPAC name of 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one (CID 97084725) is 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one.
What is the SMILES notation for 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one?
The canonical SMILES for 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one is Cn1cc(C(=O)N2CCCC[C@@H]2CCc2ccccc2)ccc1=O.
What is the InChIKey of 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one?
The InChIKey is BBSKSZPXFYJKRL-GOSISDBHSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-21-15-17(11-13-19(21)23)20(24)22-14-6-5-9-18(22)12-10-16-7-3-2-4-8-16/h2-4,7-8,11,13,15,18H,5-6,9-10,12,14H2,1H3/t18-/m1/s1.
What are the key properties of 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one?
1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one has a molecular weight of 324.42 g/mol, XLogP of 3.01, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[(2R)-2-(2-phenylethyl)piperidine-1-carbonyl]pyridin-2-one is sourced from PubChem (CID 97084725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).