1-cyclobutyl-3-(2-phenylphenyl)urea

C17H18N2O — CID 115617882

IUPAC1-cyclobutyl-3-(2-phenylphenyl)urea
SMILESO=C(Nc1ccccc1-c1ccccc1)NC1CCC1
InChIInChI=1S/C17H18N2O/c20-17(18-14-9-6-10-14)19-16-12-5-4-11-15(16)13-7-2-1-3-8-13/h1-5,7-8,11-12,14H,6,9-10H2,(H2,18,19,20)
InChIKeyTVTWXQPGRICPPN-UHFFFAOYSA-N
MW266.34 g/mol
LogP4.03
Rot. Bonds3

About 1-cyclobutyl-3-(2-phenylphenyl)urea

1-cyclobutyl-3-(2-phenylphenyl)urea (PubChem CID 115617882) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-cyclobutyl-3-(2-phenylphenyl)urea.

Molecular Properties

Compound Name1-cyclobutyl-3-(2-phenylphenyl)urea
PubChem CID115617882
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name1-cyclobutyl-3-(2-phenylphenyl)urea
SMILESO=C(Nc1ccccc1-c1ccccc1)NC1CCC1
InChIInChI=1S/C17H18N2O/c20-17(18-14-9-6-10-14)19-16-12-5-4-11-15(16)13-7-2-1-3-8-13/h1-5,7-8,11-12,14H,6,9-10H2,(H2,18,19,20)
InChIKeyTVTWXQPGRICPPN-UHFFFAOYSA-N
XLogP4.03
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 47195783
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CID 1461532
1-[1-(2-hydroxybutyl)piperidin-4-yl]-3-(2-phenylphenyl)urea
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1-(2,3-dihydro-1H-inden-1-yl)-3-(2-phenylphenyl)urea
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CID 52546181
N-[2-(cyclohexylcarbamoylamino)phenyl]acetamide
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1-cyclobutyl-3-(3-hydroxy-2-methylphenyl)urea
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CID 3671520
N-(2-phenylphenyl)oxolane-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-(2-phenylphenyl)urea?
The IUPAC name of 1-cyclobutyl-3-(2-phenylphenyl)urea (CID 115617882) is 1-cyclobutyl-3-(2-phenylphenyl)urea.
What is the SMILES notation for 1-cyclobutyl-3-(2-phenylphenyl)urea?
The canonical SMILES for 1-cyclobutyl-3-(2-phenylphenyl)urea is O=C(Nc1ccccc1-c1ccccc1)NC1CCC1.
What is the InChIKey of 1-cyclobutyl-3-(2-phenylphenyl)urea?
The InChIKey is TVTWXQPGRICPPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c20-17(18-14-9-6-10-14)19-16-12-5-4-11-15(16)13-7-2-1-3-8-13/h1-5,7-8,11-12,14H,6,9-10H2,(H2,18,19,20).
What are the key properties of 1-cyclobutyl-3-(2-phenylphenyl)urea?
1-cyclobutyl-3-(2-phenylphenyl)urea has a molecular weight of 266.34 g/mol, XLogP of 4.03, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-(2-phenylphenyl)urea is sourced from PubChem (CID 115617882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).