1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one

C22H24FN3O2 — CID 50789317

IUPAC1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one
SMILESO=C(c1ccc(F)cc1)N1CCC(N2CCN(Cc3ccccc3)C2=O)CC1
InChIInChI=1S/C22H24FN3O2/c23-19-8-6-18(7-9-19)21(27)24-12-10-20(11-13-24)26-15-14-25(22(26)28)16-17-4-2-1-3-5-17/h1-9,20H,10-16H2
InChIKeyIBOIGTQAAJJYNB-UHFFFAOYSA-N
MW381.45 g/mol
LogP3.37
Rot. Bonds4

About 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one

1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one (PubChem CID 50789317) has the molecular formula C22H24FN3O2 and a molecular weight of 381.45 g/mol. Its IUPAC name is 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one
PubChem CID50789317
Molecular FormulaC22H24FN3O2
Molecular Weight381.45 g/mol
Exact Mass381.19
IUPAC Name1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one
SMILESO=C(c1ccc(F)cc1)N1CCC(N2CCN(Cc3ccccc3)C2=O)CC1
InChIInChI=1S/C22H24FN3O2/c23-19-8-6-18(7-9-19)21(27)24-12-10-20(11-13-24)26-15-14-25(22(26)28)16-17-4-2-1-3-5-17/h1-9,20H,10-16H2
InChIKeyIBOIGTQAAJJYNB-UHFFFAOYSA-N
XLogP3.37
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.45
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-benzoyl-2-[(4-fluorophenyl)methyl]-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one
CID 162841153
1-[1-(benzenesulfonyl)piperidin-4-yl]-3-[(4-fluorophenyl)methyl]imidazolidin-2-one
CID 53083134
N-cyclopentyl-4-[3-[(4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]piperidine-1-carboxamide
CID 53098489
1-[(3-fluorophenyl)methyl]-3-[1-(furan-2-carbonyl)piperidin-4-yl]imidazolidin-2-one
CID 50789358
4-(3-benzyl-2-oxoimidazolidin-1-yl)-N-(2-bromophenyl)piperidine-1-carboxamide
CID 53098595
1-[1-(4-ethylbenzoyl)piperidin-4-yl]-3-propylimidazolidin-2-one
CID 46335587
4-(3-benzyl-2-oxoimidazolidin-1-yl)-N-(3-methylbutyl)piperidine-1-carboxamide
CID 53098629
1-[1-[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]-3-[[4-(4-hydroxypiperidine-1-carbonyl)phenyl]methyl]imidazolidin-2-one
CID 71572678
1-benzyl-3-pyrrolidin-3-ylimidazolidin-2-one
CID 82384888
(8aR)-N-benzyl-2-[(4-fluorophenyl)methyl]-3-oxo-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 75536996
1-benzyl-3-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]imidazolidin-2-one
CID 50789384
4-(3-benzyl-2-oxoimidazolidin-1-yl)-N-(5-chloro-2-methylphenyl)piperidine-1-carboxamide
CID 53098591

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one (CID 50789317) is 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one is O=C(c1ccc(F)cc1)N1CCC(N2CCN(Cc3ccccc3)C2=O)CC1.
What is the InChIKey of 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one?
The InChIKey is IBOIGTQAAJJYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FN3O2/c23-19-8-6-18(7-9-19)21(27)24-12-10-20(11-13-24)26-15-14-25(22(26)28)16-17-4-2-1-3-5-17/h1-9,20H,10-16H2.
What are the key properties of 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one?
1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one has a molecular weight of 381.45 g/mol, XLogP of 3.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-[1-(4-fluorobenzoyl)piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 50789317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).