1,3-bis(1-phenylpropan-2-yl)urea

C19H24N2O — CID 2826775

IUPAC1,3-bis(1-phenylpropan-2-yl)urea
SMILESCC(Cc1ccccc1)NC(=O)NC(C)Cc1ccccc1
InChIInChI=1S/C19H24N2O/c1-15(13-17-9-5-3-6-10-17)20-19(22)21-16(2)14-18-11-7-4-8-12-18/h3-12,15-16H,13-14H2,1-2H3,(H2,20,21,22)
InChIKeyZTPZWUDSURJLNZ-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.55
Rot. Bonds6

About 1,3-bis(1-phenylpropan-2-yl)urea

1,3-bis(1-phenylpropan-2-yl)urea (PubChem CID 2826775) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 1,3-bis(1-phenylpropan-2-yl)urea.

Molecular Properties

Compound Name1,3-bis(1-phenylpropan-2-yl)urea
PubChem CID2826775
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name1,3-bis(1-phenylpropan-2-yl)urea
SMILESCC(Cc1ccccc1)NC(=O)NC(C)Cc1ccccc1
InChIInChI=1S/C19H24N2O/c1-15(13-17-9-5-3-6-10-17)20-19(22)21-16(2)14-18-11-7-4-8-12-18/h3-12,15-16H,13-14H2,1-2H3,(H2,20,21,22)
InChIKeyZTPZWUDSURJLNZ-UHFFFAOYSA-N
XLogP3.55
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 72889
Formetamide
CID 65614
N-Cyclohexyl-N'-(Propyl)Phenyl Urea
CID 4358
N,N'-Bis(2-phenylethyl)urea
CID 95244
1-Benzyl-3-cyclohexylurea
CID 544877
Urea, N,N''-1,6-hexanediylbis[N'-(phenylmethyl)-
CID 2818389
4-benzhydryl-N-butylpiperazine-1-carboxamide
CID 2809754
(2S)-4-(2,5-difluorophenyl)-N-methyl-2-phenyl-N-(piperidin-4-yl)-2,5-dihydro-1H-pyrrole-1-carboxamide
CID 11675645
1-Cyclohexyl-3-(2-phenylethyl)urea
CID 742677
alpha-benzyl-N-methylphenethylamine
CID 93287
Iem 1365
CID 99869
Phenethylurea
CID 75089

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(1-phenylpropan-2-yl)urea?
The IUPAC name of 1,3-bis(1-phenylpropan-2-yl)urea (CID 2826775) is 1,3-bis(1-phenylpropan-2-yl)urea.
What is the SMILES notation for 1,3-bis(1-phenylpropan-2-yl)urea?
The canonical SMILES for 1,3-bis(1-phenylpropan-2-yl)urea is CC(Cc1ccccc1)NC(=O)NC(C)Cc1ccccc1.
What is the InChIKey of 1,3-bis(1-phenylpropan-2-yl)urea?
The InChIKey is ZTPZWUDSURJLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-15(13-17-9-5-3-6-10-17)20-19(22)21-16(2)14-18-11-7-4-8-12-18/h3-12,15-16H,13-14H2,1-2H3,(H2,20,21,22).
What are the key properties of 1,3-bis(1-phenylpropan-2-yl)urea?
1,3-bis(1-phenylpropan-2-yl)urea has a molecular weight of 296.41 g/mol, XLogP of 3.55, 6 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(1-phenylpropan-2-yl)urea is sourced from PubChem (CID 2826775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).