1,3-dimethyl-1-thiophen-2-ylurea

C7H10N2OS — CID 115168951

IUPAC1,3-dimethyl-1-thiophen-2-ylurea
SMILESCNC(=O)N(C)c1cccs1
InChIInChI=1S/C7H10N2OS/c1-8-7(10)9(2)6-4-3-5-11-6/h3-5H,1-2H3,(H,8,10)
InChIKeyWSPDDIWEJGZJGV-UHFFFAOYSA-N
MW170.24 g/mol
LogP1.52
Rot. Bonds1

About 1,3-dimethyl-1-thiophen-2-ylurea

1,3-dimethyl-1-thiophen-2-ylurea (PubChem CID 115168951) has the molecular formula C7H10N2OS and a molecular weight of 170.24 g/mol. Its IUPAC name is 1,3-dimethyl-1-thiophen-2-ylurea.

Molecular Properties

Compound Name1,3-dimethyl-1-thiophen-2-ylurea
PubChem CID115168951
Molecular FormulaC7H10N2OS
Molecular Weight170.24 g/mol
Exact Mass170.05
IUPAC Name1,3-dimethyl-1-thiophen-2-ylurea
SMILESCNC(=O)N(C)c1cccs1
InChIInChI=1S/C7H10N2OS/c1-8-7(10)9(2)6-4-3-5-11-6/h3-5H,1-2H3,(H,8,10)
InChIKeyWSPDDIWEJGZJGV-UHFFFAOYSA-N
XLogP1.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.24
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1,3-dimethyl-1-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

2-hydroxy-N-methyl-N-thiophen-2-ylpropanamide
CID 115140457
2-[methyl(thiophen-2-yl)carbamoyl]propanedioic acid
CID 175014913
N-methyl-4-oxo-N-thiophen-2-ylpentanamide
CID 115176753
1,1,3,3-tetrathiophen-2-ylurea
CID 19774771
2-methyl-4-[methyl(thiophen-2-yl)amino]-4-oxobutanoic acid
CID 115164997
methyl 2-methyl-2-[methyl(thiophen-2-yl)amino]propanoate
CID 115128321
1-(hydroxymethyl)-N-methyl-N-thiophen-2-ylcyclobutane-1-carboxamide
CID 115183976
(1S,2R,3S,4S)-3-[methyl(thiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 90150394
(1S,2S,3S,4R)-3-[methyl(thiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 135353747
1-methyl-1-propan-2-yl-3-thiophen-2-ylurea
CID 131131659
methylcarbamoyl thiophene-2-carboxylate
CID 143396062
N,2-dimethyl-3-piperazin-1-yl-N-thiophen-2-ylpropanamide
CID 115189078

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-1-thiophen-2-ylurea?
The IUPAC name of 1,3-dimethyl-1-thiophen-2-ylurea (CID 115168951) is 1,3-dimethyl-1-thiophen-2-ylurea.
What is the SMILES notation for 1,3-dimethyl-1-thiophen-2-ylurea?
The canonical SMILES for 1,3-dimethyl-1-thiophen-2-ylurea is CNC(=O)N(C)c1cccs1.
What is the InChIKey of 1,3-dimethyl-1-thiophen-2-ylurea?
The InChIKey is WSPDDIWEJGZJGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2OS/c1-8-7(10)9(2)6-4-3-5-11-6/h3-5H,1-2H3,(H,8,10).
What are the key properties of 1,3-dimethyl-1-thiophen-2-ylurea?
1,3-dimethyl-1-thiophen-2-ylurea has a molecular weight of 170.24 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-1-thiophen-2-ylurea is sourced from PubChem (CID 115168951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).