5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one

C23H23N3O3 — CID 91954902

IUPAC5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one
SMILESCOc1ccccc1N1CCN(C(=O)c2ccc(=O)n(-c3ccccc3)c2)CC1
InChIInChI=1S/C23H23N3O3/c1-29-21-10-6-5-9-20(21)24-13-15-25(16-14-24)23(28)18-11-12-22(27)26(17-18)19-7-3-2-4-8-19/h2-12,17H,13-16H2,1H3
InChIKeyYGCHCGONIASHIV-UHFFFAOYSA-N
MW389.46 g/mol
LogP2.81
Rot. Bonds4

About 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one

5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one (PubChem CID 91954902) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one.

Molecular Properties

Compound Name5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one
PubChem CID91954902
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one
SMILESCOc1ccccc1N1CCN(C(=O)c2ccc(=O)n(-c3ccccc3)c2)CC1
InChIInChI=1S/C23H23N3O3/c1-29-21-10-6-5-9-20(21)24-13-15-25(16-14-24)23(28)18-11-12-22(27)26(17-18)19-7-3-2-4-8-19/h2-12,17H,13-16H2,1H3
InChIKeyYGCHCGONIASHIV-UHFFFAOYSA-N
XLogP2.81
TPSA54.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]-1-(1-methylpyrazol-4-yl)pyridin-2-one
CID 139003459
5-(4-ethylpiperazine-1-carbonyl)-1-phenylpyridin-2-one
CID 91945531
1-(4-fluorophenyl)-5-[4-(4-methoxyphenyl)piperazine-1-carbonyl]pyridin-2-one
CID 91955128
5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1-(4-methoxyphenyl)pyridin-2-one
CID 91955023
(3,4-dihydroxyphenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 113199237
[2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 4116089
1-[3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]pyrrolidine-2,5-dione
CID 9335620
[4-(2-methoxyphenyl)piperazin-1-yl]-(1-phenyltriazol-4-yl)methanone
CID 46547494
[4-(2-methoxyphenyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanone
CID 2994482
5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1,3-dimethylpyrimidine-2,4-dione
CID 84556273
2,3-dihydro-1H-inden-5-yl-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 9118183
5-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1-phenylpyridin-2-one
CID 97465061

Frequently Asked Questions

What is the IUPAC name of 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one?
The IUPAC name of 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one (CID 91954902) is 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one.
What is the SMILES notation for 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one?
The canonical SMILES for 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one is COc1ccccc1N1CCN(C(=O)c2ccc(=O)n(-c3ccccc3)c2)CC1.
What is the InChIKey of 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one?
The InChIKey is YGCHCGONIASHIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-29-21-10-6-5-9-20(21)24-13-15-25(16-14-24)23(28)18-11-12-22(27)26(17-18)19-7-3-2-4-8-19/h2-12,17H,13-16H2,1H3.
What are the key properties of 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one?
5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one has a molecular weight of 389.46 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-phenylpyridin-2-one is sourced from PubChem (CID 91954902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).