3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one

C16H17N3O2 — CID 25333485

IUPAC3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one
SMILESO=C(c1ccc[nH]c1=O)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C16H17N3O2/c20-15-14(7-4-8-17-15)16(21)19-11-9-18(10-12-19)13-5-2-1-3-6-13/h1-8H,9-12H2,(H,17,20)
InChIKeyJCONQVFTZQWZCU-UHFFFAOYSA-N
MW283.33 g/mol
LogP1.34
Rot. Bonds2

About 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one

3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one (PubChem CID 25333485) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one
PubChem CID25333485
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one
SMILESO=C(c1ccc[nH]c1=O)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C16H17N3O2/c20-15-14(7-4-8-17-15)16(21)19-11-9-18(10-12-19)13-5-2-1-3-6-13/h1-8H,9-12H2,(H,17,20)
InChIKeyJCONQVFTZQWZCU-UHFFFAOYSA-N
XLogP1.34
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-phenylpiperazin-1-yl)-(1H-pyrrol-2-yl)methanone
CID 51210665
3-[4-(2-methyl-2-phenylpropanoyl)piperazine-1-carbonyl]-1H-pyridin-2-one
CID 38454222
3-(3,4-dihydroxypyrrolidine-1-carbonyl)-1H-pyridin-2-one
CID 106671277
2-[2-(4-phenylpiperazine-1-carbonyl)phenyl]isoindole-1,3-dione
CID 168517823
3-[4-(4-pyrrolidin-1-ylquinazolin-6-yl)piperazine-1-carbonyl]-1H-pyridin-2-one
CID 126896027
5-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one
CID 4826168
(3-amino-2-hydroxyphenyl)-(4-phenylpiperazin-1-yl)methanone
CID 58736410
(2-fluorophenyl)-[4-(4-fluorophenyl)piperazin-1-yl]methanone
CID 798980
(4,5-dimethylthiophen-3-yl)-(4-phenylpiperazin-1-yl)methanone
CID 17193912
3-(3-aminopyrrolidine-1-carbonyl)-1H-pyridin-2-one
CID 62068733
(4-phenylpiperazin-1-yl)-(2-pyrrolidin-1-yl-3-pyridinyl)methanone
CID 8934171
2-(2-oxo-1H-pyridine-3-carbonyl)-1,3-dihydroisoindole-5-carboxylic acid
CID 103997152

Frequently Asked Questions

What is the IUPAC name of 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one (CID 25333485) is 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one is O=C(c1ccc[nH]c1=O)N1CCN(c2ccccc2)CC1.
What is the InChIKey of 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one?
The InChIKey is JCONQVFTZQWZCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c20-15-14(7-4-8-17-15)16(21)19-11-9-18(10-12-19)13-5-2-1-3-6-13/h1-8H,9-12H2,(H,17,20).
What are the key properties of 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one?
3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one has a molecular weight of 283.33 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-phenylpiperazine-1-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 25333485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).