1-(2,2-diphenylethyl)-3-methylurea

C16H18N2O — CID 23548569

IUPAC1-(2,2-diphenylethyl)-3-methylurea
SMILESCNC(=O)NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18N2O/c1-17-16(19)18-12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,12H2,1H3,(H2,17,18,19)
InChIKeyJVGPQJHJWPNZLZ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.75
Rot. Bonds4

About 1-(2,2-diphenylethyl)-3-methylurea

1-(2,2-diphenylethyl)-3-methylurea (PubChem CID 23548569) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-(2,2-diphenylethyl)-3-methylurea.

Molecular Properties

Compound Name1-(2,2-diphenylethyl)-3-methylurea
PubChem CID23548569
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name1-(2,2-diphenylethyl)-3-methylurea
SMILESCNC(=O)NCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18N2O/c1-17-16(19)18-12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,12H2,1H3,(H2,17,18,19)
InChIKeyJVGPQJHJWPNZLZ-UHFFFAOYSA-N
XLogP2.75
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-(2,2-diphenylethyl)-3-methylurea 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

Amperozide
CID 73333
Urea, N,N'-bis(phenylmethyl)-
CID 72889
Urea, N,N''-1,6-hexanediylbis[N'-(phenylmethyl)-
CID 2818389
Amperozide Hydrochloride
CID 73334
N-Cyclohexyl-N'-(Propyl)Phenyl Urea
CID 4358
Phenethylurea
CID 75089
N,N'-Bis(2-phenylethyl)urea
CID 95244
1-Benzyl-3-cyclohexylurea
CID 544877
4-benzhydryl-N-butylpiperazine-1-carboxamide
CID 2809754
1-Cyclohexyl-3-(2-phenylethyl)urea
CID 742677
N-methyl-4,4-diphenylbutan-1-amine
CID 20293994
N-(Diphenylmethyl)urea
CID 95253

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-diphenylethyl)-3-methylurea?
The IUPAC name of 1-(2,2-diphenylethyl)-3-methylurea (CID 23548569) is 1-(2,2-diphenylethyl)-3-methylurea.
What is the SMILES notation for 1-(2,2-diphenylethyl)-3-methylurea?
The canonical SMILES for 1-(2,2-diphenylethyl)-3-methylurea is CNC(=O)NCC(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-(2,2-diphenylethyl)-3-methylurea?
The InChIKey is JVGPQJHJWPNZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-17-16(19)18-12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,12H2,1H3,(H2,17,18,19).
What are the key properties of 1-(2,2-diphenylethyl)-3-methylurea?
1-(2,2-diphenylethyl)-3-methylurea has a molecular weight of 254.33 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-diphenylethyl)-3-methylurea is sourced from PubChem (CID 23548569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).