(4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one

C17H15N3O — CID 135604884

IUPAC(4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one
SMILESO=C1NC(=C\c2ccccc2)/C(=N/Cc2ccccc2)N1
InChIInChI=1S/C17H15N3O/c21-17-19-15(11-13-7-3-1-4-8-13)16(20-17)18-12-14-9-5-2-6-10-14/h1-11H,12H2,(H2,18,19,20,21)/b15-11-
InChIKeyLJJBJHYLAFQDIG-PTNGSMBKSA-N
MW277.33 g/mol
LogP2.94
Rot. Bonds3

About (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one

(4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one (PubChem CID 135604884) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one.

Molecular Properties

Compound Name(4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one
PubChem CID135604884
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name(4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one
SMILESO=C1NC(=C\c2ccccc2)/C(=N/Cc2ccccc2)N1
InChIInChI=1S/C17H15N3O/c21-17-19-15(11-13-7-3-1-4-8-13)16(20-17)18-12-14-9-5-2-6-10-14/h1-11H,12H2,(H2,18,19,20,21)/b15-11-
InChIKeyLJJBJHYLAFQDIG-PTNGSMBKSA-N
XLogP2.94
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl (5Z)-5-benzylidene-2-benzylimino-4-methoxypyrrole-3-carboxylate
CID 135746766
4-benzylidene-5-sulfanylideneimidazolidin-2-one
CID 71365498
(5E)-5-benzylideneimidazolidine-2,4-dione;ethane
CID 91247316
5-benzylidene-2-benzylimino-1,3-thiazolidin-4-one
CID 135538834
(5E)-5-benzylidene-2-benzylimino-3-(4-methylphenyl)imidazolidin-4-one
CID 136911485
methyl (5Z)-4-(benzylamino)-5-benzylidene-2-benzyliminopyrrole-3-carboxylate
CID 135746767
(5Z)-5-[(3-phenylphenyl)methylidene]imidazolidine-2,4-dione
CID 44590759
(5E)-5-[(3,5-dichloro-4-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione
CID 126053946
(3Z,6S)-6-benzyl-3-benzylidene-1-methylpiperazine-2,5-dione
CID 102507009
(5E)-3-(benzyliminomethyl)-4-hydroxy-5-[(4-methoxyphenyl)methylidene]pyrrol-2-one
CID 135802020
(3E)-3-benzylidene-6-sulfanylidenepiperazine-2,5-dione
CID 167946469
2-benzylimino-5-prop-2-enyl-1,3-diazinane-4,6-dione
CID 135416868

Frequently Asked Questions

What is the IUPAC name of (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one?
The IUPAC name of (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one (CID 135604884) is (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one.
What is the SMILES notation for (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one?
The canonical SMILES for (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one is O=C1NC(=C\c2ccccc2)/C(=N/Cc2ccccc2)N1.
What is the InChIKey of (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one?
The InChIKey is LJJBJHYLAFQDIG-PTNGSMBKSA-N. The full InChI is InChI=1S/C17H15N3O/c21-17-19-15(11-13-7-3-1-4-8-13)16(20-17)18-12-14-9-5-2-6-10-14/h1-11H,12H2,(H2,18,19,20,21)/b15-11-.
What are the key properties of (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one?
(4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one has a molecular weight of 277.33 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-benzylidene-5-benzyliminoimidazolidin-2-one is sourced from PubChem (CID 135604884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).