4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one

C21H25N3O — CID 141144551

IUPAC4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one
SMILESO=C1NCC(c2ccccc2)(C2CCN(Cc3ccccc3)CC2)N1
InChIInChI=1S/C21H25N3O/c25-20-22-16-21(23-20,18-9-5-2-6-10-18)19-11-13-24(14-12-19)15-17-7-3-1-4-8-17/h1-10,19H,11-16H2,(H2,22,23,25)
InChIKeyBAHIXUSROGIWDR-UHFFFAOYSA-N
MW335.45 g/mol
LogP3.11
Rot. Bonds4

About 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one

4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one (PubChem CID 141144551) has the molecular formula C21H25N3O and a molecular weight of 335.45 g/mol. Its IUPAC name is 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one.

Molecular Properties

Compound Name4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one
PubChem CID141144551
Molecular FormulaC21H25N3O
Molecular Weight335.45 g/mol
Exact Mass335.20
IUPAC Name4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one
SMILESO=C1NCC(c2ccccc2)(C2CCN(Cc3ccccc3)CC2)N1
InChIInChI=1S/C21H25N3O/c25-20-22-16-21(23-20,18-9-5-2-6-10-18)19-11-13-24(14-12-19)15-17-7-3-1-4-8-17/h1-10,19H,11-16H2,(H2,22,23,25)
InChIKeyBAHIXUSROGIWDR-UHFFFAOYSA-N
XLogP3.11
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-benzylpiperidin-4-yl)-4,4-diphenylimidazolidin-2-one
CID 11718536
1-benzyl-4-isocyano-4-phenylpiperidine
CID 20812471
5-[1-[(3,5-difluorophenyl)methyl]piperidin-4-yl]-5-(2-phenylethyl)imidazolidine-2,4-dione
CID 45188706
5-[1-[(4-ethylphenyl)methyl]piperidin-4-yl]-5-(2-phenylethyl)imidazolidine-2,4-dione
CID 45195590
(3aS,7aS)-5-benzyl-3a-hydroxy-2,3,4,6,7,7a-hexahydropyrrolo[3,4-c]pyridin-1-one
CID 163394366
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
CID 160853215
5-benzyl-5-[1-(quinolin-6-ylmethyl)piperidin-4-yl]imidazolidine-2,4-dione
CID 45181974
1-benzyl-2,2,4-trideuterio-4-(trideuteriomethyl)piperidin-3-one
CID 59575832
1-(1-benzylazepan-4-yl)cyclopropan-1-amine
CID 83912862
1-benzyl-N,N-dicyclopropylpiperidin-4-amine
CID 11097616
(5S)-5-(1-benzylpiperidin-4-yl)-3-[[(2R)-oxolan-2-yl]methyl]-5-pyridin-2-ylimidazolidine-2,4-dione
CID 42340144
1-benzylpiperidine-4-carbonyl chloride
CID 18919767

Frequently Asked Questions

What is the IUPAC name of 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one?
The IUPAC name of 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one (CID 141144551) is 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one.
What is the SMILES notation for 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one?
The canonical SMILES for 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one is O=C1NCC(c2ccccc2)(C2CCN(Cc3ccccc3)CC2)N1.
What is the InChIKey of 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one?
The InChIKey is BAHIXUSROGIWDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O/c25-20-22-16-21(23-20,18-9-5-2-6-10-18)19-11-13-24(14-12-19)15-17-7-3-1-4-8-17/h1-10,19H,11-16H2,(H2,22,23,25).
What are the key properties of 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one?
4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one has a molecular weight of 335.45 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-benzylpiperidin-4-yl)-4-phenylimidazolidin-2-one is sourced from PubChem (CID 141144551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).