1,2-diphenylethylurea

C15H16N2O — CID 2853470

IUPAC1,2-diphenylethylurea
SMILESNC(=O)NC(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H16N2O/c16-15(18)17-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H3,16,17,18)
InChIKeyFEUKXAYBBVOZJE-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.64
Rot. Bonds4

About 1,2-diphenylethylurea

1,2-diphenylethylurea (PubChem CID 2853470) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 1,2-diphenylethylurea.

Molecular Properties

Compound Name1,2-diphenylethylurea
PubChem CID2853470
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name1,2-diphenylethylurea
SMILESNC(=O)NC(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C15H16N2O/c16-15(18)17-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H3,16,17,18)
InChIKeyFEUKXAYBBVOZJE-UHFFFAOYSA-N
XLogP2.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1,2-diphenylethyl)-3-methylurea
CID 23548551
methyl N-(1,2-diphenylethyl)carbamate
CID 139785732
6-amino-N-(1,2-diphenylethyl)hexanamide
CID 42792343
N-[(1S)-1,2-diphenylethyl]-2,2-dimethylpropanamide
CID 41097241
(3-bromo-1-phenylpropyl)urea
CID 118035528
1-phenylbutylurea
CID 2852079
N-(1,2-diphenylethyl)-2,2-dimethoxyacetamide
CID 21419374
N-[(1S)-1,2-diphenylethyl]hydroxylamine
CID 163358827
N-(1,2-diphenylethyl)hydroxylamine
CID 82685199
2-amino-N-(1,2-diphenylethyl)pentanamide;hydrochloride
CID 119271471
1-[(1S)-1,2-diphenylethyl]-3-prop-2-ynylurea
CID 36512732
2-(1,2-diphenylethylamino)ethyl carbamate
CID 83191437

Frequently Asked Questions

What is the IUPAC name of 1,2-diphenylethylurea?
The IUPAC name of 1,2-diphenylethylurea (CID 2853470) is 1,2-diphenylethylurea.
What is the SMILES notation for 1,2-diphenylethylurea?
The canonical SMILES for 1,2-diphenylethylurea is NC(=O)NC(Cc1ccccc1)c1ccccc1.
What is the InChIKey of 1,2-diphenylethylurea?
The InChIKey is FEUKXAYBBVOZJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c16-15(18)17-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H3,16,17,18).
What are the key properties of 1,2-diphenylethylurea?
1,2-diphenylethylurea has a molecular weight of 240.31 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenylethylurea is sourced from PubChem (CID 2853470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).