3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one

C24H25N3O2 — CID 120740709

IUPAC3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
SMILESCCc1ccc(C2CNCCN2C(=O)c2ccc(-c3ccccc3)[nH]c2=O)cc1
InChIInChI=1S/C24H25N3O2/c1-2-17-8-10-19(11-9-17)22-16-25-14-15-27(22)24(29)20-12-13-21(26-23(20)28)18-6-4-3-5-7-18/h3-13,22,25H,2,14-16H2,1H3,(H,26,28)
InChIKeyFYUAPKSELUUKHY-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.39
Rot. Bonds4

About 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one

3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one (PubChem CID 120740709) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
PubChem CID120740709
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one
SMILESCCc1ccc(C2CNCCN2C(=O)c2ccc(-c3ccccc3)[nH]c2=O)cc1
InChIInChI=1S/C24H25N3O2/c1-2-17-8-10-19(11-9-17)22-16-25-14-15-27(22)24(29)20-12-13-21(26-23(20)28)18-6-4-3-5-7-18/h3-13,22,25H,2,14-16H2,1H3,(H,26,28)
InChIKeyFYUAPKSELUUKHY-UHFFFAOYSA-N
XLogP3.39
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-(furan-2-yl)-1H-pyridin-2-one;hydrochloride
CID 120741124
3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one;hydrochloride
CID 120740205
5-[2-(4-ethylphenyl)piperazine-1-carbonyl]-2-methyl-1H-pyridin-4-one
CID 120741559
6-[2-(4-ethylphenyl)piperazine-1-carbonyl]-2-phenylpyridazin-3-one
CID 120740250
1,3-benzodioxol-4-yl-[2-(4-ethylphenyl)piperazin-1-yl]methanone
CID 120740907
4-[2-(4-ethylphenyl)piperazine-1-carbonyl]benzamide;hydrochloride
CID 120740508
1-[2-(4-ethylphenyl)piperazin-1-yl]butan-1-one
CID 120740551
1-[2-(4-ethylphenyl)piperazin-1-yl]-2-phenoxyethanone;hydrochloride
CID 120741482
1-[2-(4-ethylphenyl)piperazin-1-yl]-2-methylbutan-1-one;hydrochloride
CID 120741416
2,3-dihydro-1-benzofuran-2-yl-[2-(4-ethylphenyl)piperazin-1-yl]methanone;hydrochloride
CID 120740500
(3-chloro-4-pyridinyl)-[2-(4-ethylphenyl)piperazin-1-yl]methanone;dihydrochloride
CID 120740616
[2-(4-ethylphenyl)piperazin-1-yl]-(3-pyridin-2-yl-1,2-oxazol-5-yl)methanone;dihydrochloride
CID 120740792

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one?
The IUPAC name of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one (CID 120740709) is 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one.
What is the SMILES notation for 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one?
The canonical SMILES for 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one is CCc1ccc(C2CNCCN2C(=O)c2ccc(-c3ccccc3)[nH]c2=O)cc1.
What is the InChIKey of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one?
The InChIKey is FYUAPKSELUUKHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-2-17-8-10-19(11-9-17)22-16-25-14-15-27(22)24(29)20-12-13-21(26-23(20)28)18-6-4-3-5-7-18/h3-13,22,25H,2,14-16H2,1H3,(H,26,28).
What are the key properties of 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one?
3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one has a molecular weight of 387.48 g/mol, XLogP of 3.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-ethylphenyl)piperazine-1-carbonyl]-6-phenyl-1H-pyridin-2-one is sourced from PubChem (CID 120740709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).