1-(3-methylphenyl)-3-thiophen-2-ylurea

C12H12N2OS — CID 108889157

IUPAC1-(3-methylphenyl)-3-thiophen-2-ylurea
SMILESCc1cccc(NC(=O)Nc2cccs2)c1
InChIInChI=1S/C12H12N2OS/c1-9-4-2-5-10(8-9)13-12(15)14-11-6-3-7-16-11/h2-8H,1H3,(H2,13,14,15)
InChIKeyAMZHNAPZKWTRIV-UHFFFAOYSA-N
MW232.31 g/mol
LogP3.70
Rot. Bonds2

About 1-(3-methylphenyl)-3-thiophen-2-ylurea

1-(3-methylphenyl)-3-thiophen-2-ylurea (PubChem CID 108889157) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is 1-(3-methylphenyl)-3-thiophen-2-ylurea.

Molecular Properties

Compound Name1-(3-methylphenyl)-3-thiophen-2-ylurea
PubChem CID108889157
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC Name1-(3-methylphenyl)-3-thiophen-2-ylurea
SMILESCc1cccc(NC(=O)Nc2cccs2)c1
InChIInChI=1S/C12H12N2OS/c1-9-4-2-5-10(8-9)13-12(15)14-11-6-3-7-16-11/h2-8H,1H3,(H2,13,14,15)
InChIKeyAMZHNAPZKWTRIV-UHFFFAOYSA-N
XLogP3.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(3-methylphenyl)-3-thiophen-2-ylurea 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-(3-methylsulfanylphenyl)-3-thiophen-2-ylurea
CID 108889171
1-(3-methylphenyl)-3-(4-methylphenyl)urea
CID 12560219
ethane;1-(3-methylphenyl)-3-(4-methylphenyl)urea
CID 144571774
1-(3-methylphenyl)-3-[4-[4-[(3-methylphenyl)carbamoylamino]phenyl]phenyl]urea
CID 1239967
1-hydroxy-3-(3-methylphenyl)urea
CID 10034960
1-(4-hydroxyphenyl)-3-thiophen-2-ylurea
CID 108889117
1-(3,4-dimethylphenyl)-3-(3-methylphenyl)urea
CID 2985670
N-(3-methylphenyl)acetamide
CID 10843
1-[4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]phenyl]-3-thiophen-2-ylurea
CID 122297869
1-(3-chloro-4-methylphenyl)-3-(3-methylphenyl)urea
CID 727838
1-(3-methylphenyl)-3-(6-methyl-2-pyridinyl)urea
CID 6468393
1-(2-fluoro-5-methylphenyl)-3-(3-methylphenyl)urea
CID 6467653

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)-3-thiophen-2-ylurea?
The IUPAC name of 1-(3-methylphenyl)-3-thiophen-2-ylurea (CID 108889157) is 1-(3-methylphenyl)-3-thiophen-2-ylurea.
What is the SMILES notation for 1-(3-methylphenyl)-3-thiophen-2-ylurea?
The canonical SMILES for 1-(3-methylphenyl)-3-thiophen-2-ylurea is Cc1cccc(NC(=O)Nc2cccs2)c1.
What is the InChIKey of 1-(3-methylphenyl)-3-thiophen-2-ylurea?
The InChIKey is AMZHNAPZKWTRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c1-9-4-2-5-10(8-9)13-12(15)14-11-6-3-7-16-11/h2-8H,1H3,(H2,13,14,15).
What are the key properties of 1-(3-methylphenyl)-3-thiophen-2-ylurea?
1-(3-methylphenyl)-3-thiophen-2-ylurea has a molecular weight of 232.31 g/mol, XLogP of 3.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)-3-thiophen-2-ylurea is sourced from PubChem (CID 108889157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).