1-(2-bromophenyl)-3-(2-methoxyphenyl)urea

C14H13BrN2O2 — CID 6467610

IUPAC1-(2-bromophenyl)-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)Nc1ccccc1Br
InChIInChI=1S/C14H13BrN2O2/c1-19-13-9-5-4-8-12(13)17-14(18)16-11-7-3-2-6-10(11)15/h2-9H,1H3,(H2,16,17,18)
InChIKeyRKPHYCPTGBOPTQ-UHFFFAOYSA-N
MW321.17 g/mol
LogP4.10
Rot. Bonds3

About 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea

1-(2-bromophenyl)-3-(2-methoxyphenyl)urea (PubChem CID 6467610) has the molecular formula C14H13BrN2O2 and a molecular weight of 321.17 g/mol. Its IUPAC name is 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea.

Molecular Properties

Compound Name1-(2-bromophenyl)-3-(2-methoxyphenyl)urea
PubChem CID6467610
Molecular FormulaC14H13BrN2O2
Molecular Weight321.17 g/mol
Exact Mass320.02
IUPAC Name1-(2-bromophenyl)-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)Nc1ccccc1Br
InChIInChI=1S/C14H13BrN2O2/c1-19-13-9-5-4-8-12(13)17-14(18)16-11-7-3-2-6-10(11)15/h2-9H,1H3,(H2,16,17,18)
InChIKeyRKPHYCPTGBOPTQ-UHFFFAOYSA-N
XLogP4.10
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2-bromophenyl)-3-(2-methoxyphenyl)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

2-Ureidoanisole
CID 98753
N-(4-Bromophenyl)-N'-[2-(2-fluorophenoxy)ethyl]urea
CID 598849
1-Cyclohexyl-3-(2-methoxyphenyl)urea
CID 307293
1-(2-Methoxyphenyl)-3-(4-methoxyphenyl)urea
CID 295260
1-(4-Methoxyphenyl)-3-phenylurea
CID 302847
N-(2,5-difluorophenyl)-N'-(2-methoxyphenyl)urea
CID 6465039
N-[3-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide
CID 6467748
1-Carbamoyl-3-(2-methoxyphenyl)urea
CID 762507
Carbanilide, 2-methoxy-
CID 295248
1,3-Bis(2-methoxyphenyl)thiourea
CID 706972
N-(2-Ethoxyphenyl)urea
CID 120184
1-(2-Methoxyphenyl)-3-(O-tolyl)urea
CID 295285

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea?
The IUPAC name of 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea (CID 6467610) is 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea.
What is the SMILES notation for 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea?
The canonical SMILES for 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea is COc1ccccc1NC(=O)Nc1ccccc1Br.
What is the InChIKey of 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea?
The InChIKey is RKPHYCPTGBOPTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrN2O2/c1-19-13-9-5-4-8-12(13)17-14(18)16-11-7-3-2-6-10(11)15/h2-9H,1H3,(H2,16,17,18).
What are the key properties of 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea?
1-(2-bromophenyl)-3-(2-methoxyphenyl)urea has a molecular weight of 321.17 g/mol, XLogP of 4.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromophenyl)-3-(2-methoxyphenyl)urea is sourced from PubChem (CID 6467610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).