1-cyclobutyl-3-(4-phenoxyphenyl)urea

C17H18N2O2 — CID 23959001

IUPAC1-cyclobutyl-3-(4-phenoxyphenyl)urea
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)NC1CCC1
InChIInChI=1S/C17H18N2O2/c20-17(18-13-5-4-6-13)19-14-9-11-16(12-10-14)21-15-7-2-1-3-8-15/h1-3,7-13H,4-6H2,(H2,18,19,20)
InChIKeyIWRIVBBQUULVLC-UHFFFAOYSA-N
MW282.34 g/mol
LogP4.15
Rot. Bonds4

About 1-cyclobutyl-3-(4-phenoxyphenyl)urea

1-cyclobutyl-3-(4-phenoxyphenyl)urea (PubChem CID 23959001) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 1-cyclobutyl-3-(4-phenoxyphenyl)urea.

Molecular Properties

Compound Name1-cyclobutyl-3-(4-phenoxyphenyl)urea
PubChem CID23959001
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name1-cyclobutyl-3-(4-phenoxyphenyl)urea
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)NC1CCC1
InChIInChI=1S/C17H18N2O2/c20-17(18-13-5-4-6-13)19-14-9-11-16(12-10-14)21-15-7-2-1-3-8-15/h1-3,7-13H,4-6H2,(H2,18,19,20)
InChIKeyIWRIVBBQUULVLC-UHFFFAOYSA-N
XLogP4.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-cyclobutyl-3-(4-phenoxyphenyl)urea 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

1-(2,3-dihydro-1H-inden-2-yl)-3-(4-phenoxyphenyl)urea
CID 23734545
1-(1-acetylpiperidin-4-yl)-3-(4-phenoxyphenyl)urea
CID 25070785
2-[4-(cyclopentylcarbamoylamino)phenoxy]acetic acid
CID 63772718
1-cyclopropyl-3-[6-(4-phenoxyanilino)pyridazin-3-yl]urea
CID 113049902
2-[2-(cyclopentylcarbamoylamino)-1,3-thiazol-4-yl]-N-(4-phenoxyphenyl)acetamide
CID 41211729
4-[(3-phenoxyphenyl)carbamoylamino]cyclohexane-1-carboxylic acid
CID 122084514
1-cyclopentyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]urea
CID 110774513
1-N-cyclopropyl-1-N'-(4-phenoxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108970739
4-(cyclopropylcarbamoylamino)-N-[4-(3-methylphenoxy)phenyl]benzamide
CID 55678662
1-cyclopropyl-3-(4-ethoxyphenyl)urea
CID 17264486
1-[1-[6-(4-phenoxyphenyl)pyrimidin-4-yl]piperidin-4-yl]-3-phenylurea
CID 171350703
1-cyclopentyl-3-(4-propoxyphenyl)urea
CID 110774502

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-3-(4-phenoxyphenyl)urea?
The IUPAC name of 1-cyclobutyl-3-(4-phenoxyphenyl)urea (CID 23959001) is 1-cyclobutyl-3-(4-phenoxyphenyl)urea.
What is the SMILES notation for 1-cyclobutyl-3-(4-phenoxyphenyl)urea?
The canonical SMILES for 1-cyclobutyl-3-(4-phenoxyphenyl)urea is O=C(Nc1ccc(Oc2ccccc2)cc1)NC1CCC1.
What is the InChIKey of 1-cyclobutyl-3-(4-phenoxyphenyl)urea?
The InChIKey is IWRIVBBQUULVLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c20-17(18-13-5-4-6-13)19-14-9-11-16(12-10-14)21-15-7-2-1-3-8-15/h1-3,7-13H,4-6H2,(H2,18,19,20).
What are the key properties of 1-cyclobutyl-3-(4-phenoxyphenyl)urea?
1-cyclobutyl-3-(4-phenoxyphenyl)urea has a molecular weight of 282.34 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-3-(4-phenoxyphenyl)urea is sourced from PubChem (CID 23959001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).