1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one

C20H24N2O2 — CID 72931976

IUPAC1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one
SMILESCCn1ccc(C(=O)N2CCCC(C)(c3ccccc3)C2)cc1=O
InChIInChI=1S/C20H24N2O2/c1-3-21-13-10-16(14-18(21)23)19(24)22-12-7-11-20(2,15-22)17-8-5-4-6-9-17/h4-6,8-10,13-14H,3,7,11-12,15H2,1-2H3
InChIKeyGWOCHBWTGLJJDQ-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.06
Rot. Bonds3

About 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one

1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one (PubChem CID 72931976) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one.

Molecular Properties

Compound Name1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one
PubChem CID72931976
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one
SMILESCCn1ccc(C(=O)N2CCCC(C)(c3ccccc3)C2)cc1=O
InChIInChI=1S/C20H24N2O2/c1-3-21-13-10-16(14-18(21)23)19(24)22-12-7-11-20(2,15-22)17-8-5-4-6-9-17/h4-6,8-10,13-14H,3,7,11-12,15H2,1-2H3
InChIKeyGWOCHBWTGLJJDQ-UHFFFAOYSA-N
XLogP3.06
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(azocane-1-carbonyl)-1-ethylpyridin-2-one
CID 74249419
4-[(3S)-3-[(dimethylamino)methyl]-3-hydroxypyrrolidine-1-carbonyl]-1-ethylpyridin-2-one
CID 95720033
(1-ethyl-3-propan-2-ylpyrazol-5-yl)-[(3S)-3-methyl-3-phenylpiperidin-1-yl]methanone
CID 97285272
2-[2-methoxy-4-(3-methyl-3-phenylpiperidine-1-carbonyl)phenoxy]acetamide
CID 119129651
[(3S)-3-methyl-3-phenylpiperidin-1-yl]-(2-methylsulfanylpyrimidin-5-yl)methanone
CID 97138452
7-(cyclopropylmethyl)-2-(1-ethyl-2-oxopyridine-4-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72902847
1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one
CID 138380813
(1,2-dimethylpyrrol-3-yl)-(3-methyl-3-phenylpiperidin-1-yl)methanone
CID 72938900
1-ethyl-4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)pyridin-2-one
CID 77085377
(4-chloro-1-methylpyrrol-2-yl)-[(3S)-3-methyl-3-phenylpiperidin-1-yl]methanone
CID 97125905
4-[(3S)-3-methyl-3-phenylpiperidine-1-carbonyl]-1H-pyrrole-2-carbonitrile
CID 124615496
[4-(3-methyl-3-phenylpiperidine-1-carbonyl)phenyl]methylurea
CID 119129647

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one?
The IUPAC name of 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one (CID 72931976) is 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one.
What is the SMILES notation for 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one?
The canonical SMILES for 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one is CCn1ccc(C(=O)N2CCCC(C)(c3ccccc3)C2)cc1=O.
What is the InChIKey of 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one?
The InChIKey is GWOCHBWTGLJJDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-3-21-13-10-16(14-18(21)23)19(24)22-12-7-11-20(2,15-22)17-8-5-4-6-9-17/h4-6,8-10,13-14H,3,7,11-12,15H2,1-2H3.
What are the key properties of 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one?
1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one has a molecular weight of 324.42 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one is sourced from PubChem (CID 72931976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).