1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one

C22H25N3O3 — CID 138998320

IUPAC1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one
SMILESCOc1ccc(C(=O)N2CCCC(N3CCNC3=O)C2)cc1-c1ccccc1
InChIInChI=1S/C22H25N3O3/c1-28-20-10-9-17(14-19(20)16-6-3-2-4-7-16)21(26)24-12-5-8-18(15-24)25-13-11-23-22(25)27/h2-4,6-7,9-10,14,18H,5,8,11-13,15H2,1H3,(H,23,27)
InChIKeyZPLBTTVBMZNOLO-UHFFFAOYSA-N
MW379.46 g/mol
LogP2.99
Rot. Bonds4

About 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one

1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one (PubChem CID 138998320) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one
PubChem CID138998320
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC Name1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one
SMILESCOc1ccc(C(=O)N2CCCC(N3CCNC3=O)C2)cc1-c1ccccc1
InChIInChI=1S/C22H25N3O3/c1-28-20-10-9-17(14-19(20)16-6-3-2-4-7-16)21(26)24-12-5-8-18(15-24)25-13-11-23-22(25)27/h2-4,6-7,9-10,14,18H,5,8,11-13,15H2,1H3,(H,23,27)
InChIKeyZPLBTTVBMZNOLO-UHFFFAOYSA-N
XLogP2.99
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[2-(5-acetyl-2-methoxyphenyl)acetyl]piperidin-3-yl]imidazolidin-2-one
CID 136579529
1-(4-methoxy-3-phenylbenzoyl)piperidine-4-carboxamide
CID 49316648
1-[(3S)-1-(2-methoxypyridine-3-carbonyl)piperidin-3-yl]imidazolidin-2-one
CID 95591065
1-(2-methoxyethyl)-5-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]pyridin-2-one
CID 56800020
1-(4-methoxy-3-pyridin-2-ylbenzoyl)piperidine-3-carboxylic acid
CID 120512544
1-[(3S)-1-[2-(3-methoxyphenyl)sulfanylacetyl]piperidin-3-yl]imidazolidin-2-one
CID 96533462
[(2R)-2-(aminomethyl)piperidin-1-yl]-(4-methoxy-3-phenylphenyl)methanone
CID 124688652
1-[(3S)-1-(3-methyl-1-benzothiophene-2-carbonyl)piperidin-3-yl]imidazolidin-2-one
CID 95585674
1-[1-[2-[benzyl(methyl)amino]acetyl]piperidin-3-yl]imidazolidin-2-one
CID 56821742
(3R)-N-benzyl-3-(2-oxoimidazolidin-1-yl)piperidine-1-carboxamide
CID 95047911
1-(3-bromo-4-methoxybenzoyl)piperidine-3-carboxylic acid
CID 43241951
(3S,8aS)-2-[4-(2-methoxyphenyl)benzoyl]-3-methyl-1,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-4-one
CID 137336793

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one (CID 138998320) is 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one is COc1ccc(C(=O)N2CCCC(N3CCNC3=O)C2)cc1-c1ccccc1.
What is the InChIKey of 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one?
The InChIKey is ZPLBTTVBMZNOLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-28-20-10-9-17(14-19(20)16-6-3-2-4-7-16)21(26)24-12-5-8-18(15-24)25-13-11-23-22(25)27/h2-4,6-7,9-10,14,18H,5,8,11-13,15H2,1H3,(H,23,27).
What are the key properties of 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one?
1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one has a molecular weight of 379.46 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methoxy-3-phenylbenzoyl)piperidin-3-yl]imidazolidin-2-one is sourced from PubChem (CID 138998320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).