1-propan-2-yl-3-thiophen-2-ylurea

C8H12N2OS — CID 3245119

IUPAC1-propan-2-yl-3-thiophen-2-ylurea
SMILESCC(C)NC(=O)Nc1cccs1
InChIInChI=1S/C8H12N2OS/c1-6(2)9-8(11)10-7-4-3-5-12-7/h3-6H,1-2H3,(H2,9,10,11)
InChIKeyODMFSEZPSZSYEZ-UHFFFAOYSA-N
MW184.26 g/mol
LogP2.28
Rot. Bonds2

About 1-propan-2-yl-3-thiophen-2-ylurea

1-propan-2-yl-3-thiophen-2-ylurea (PubChem CID 3245119) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 1-propan-2-yl-3-thiophen-2-ylurea.

Molecular Properties

Compound Name1-propan-2-yl-3-thiophen-2-ylurea
PubChem CID3245119
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name1-propan-2-yl-3-thiophen-2-ylurea
SMILESCC(C)NC(=O)Nc1cccs1
InChIInChI=1S/C8H12N2OS/c1-6(2)9-8(11)10-7-4-3-5-12-7/h3-6H,1-2H3,(H2,9,10,11)
InChIKeyODMFSEZPSZSYEZ-UHFFFAOYSA-N
XLogP2.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-propan-2-yl-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

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-3-thiophen-2-ylurea?
The IUPAC name of 1-propan-2-yl-3-thiophen-2-ylurea (CID 3245119) is 1-propan-2-yl-3-thiophen-2-ylurea.
What is the SMILES notation for 1-propan-2-yl-3-thiophen-2-ylurea?
The canonical SMILES for 1-propan-2-yl-3-thiophen-2-ylurea is CC(C)NC(=O)Nc1cccs1.
What is the InChIKey of 1-propan-2-yl-3-thiophen-2-ylurea?
The InChIKey is ODMFSEZPSZSYEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-6(2)9-8(11)10-7-4-3-5-12-7/h3-6H,1-2H3,(H2,9,10,11).
What are the key properties of 1-propan-2-yl-3-thiophen-2-ylurea?
1-propan-2-yl-3-thiophen-2-ylurea has a molecular weight of 184.26 g/mol, XLogP of 2.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-3-thiophen-2-ylurea is sourced from PubChem (CID 3245119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).