1-cyclopentyl-3-(thiophen-2-ylmethyl)urea

C11H16N2OS — CID 17174400

IUPAC1-cyclopentyl-3-(thiophen-2-ylmethyl)urea
SMILESO=C(NCc1cccs1)NC1CCCC1
InChIInChI=1S/C11H16N2OS/c14-11(13-9-4-1-2-5-9)12-8-10-6-3-7-15-10/h3,6-7,9H,1-2,4-5,8H2,(H2,12,13,14)
InChIKeyZMTCIGPBNIYFKH-UHFFFAOYSA-N
MW224.33 g/mol
LogP2.49
Rot. Bonds3

About 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea

1-cyclopentyl-3-(thiophen-2-ylmethyl)urea (PubChem CID 17174400) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea.

Molecular Properties

Compound Name1-cyclopentyl-3-(thiophen-2-ylmethyl)urea
PubChem CID17174400
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name1-cyclopentyl-3-(thiophen-2-ylmethyl)urea
SMILESO=C(NCc1cccs1)NC1CCCC1
InChIInChI=1S/C11H16N2OS/c14-11(13-9-4-1-2-5-9)12-8-10-6-3-7-15-10/h3,6-7,9H,1-2,4-5,8H2,(H2,12,13,14)
InChIKeyZMTCIGPBNIYFKH-UHFFFAOYSA-N
XLogP2.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-cyclopentyl-3-(thiophen-2-ylmethyl)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

((Thiophen-2-yl)methyl)urea
CID 2799110
(2-(Thiophen-2-yl)ethyl)urea
CID 4962323
N-isopropyl-N'-(2-thienylmethyl)thiourea
CID 972147
1-Cyclohexyl-3-(1-thiophen-2-ylpropan-2-yl)urea
CID 2999174
1-Cyclohexyl-3-(thiophen-2-ylmethyl)urea
CID 649999
N-hydroxy-N-(1-thien-2-ylethyl)urea
CID 10726208
Dimethyl-[2-methyl-1-[[(2R)-2-thiophen-2-ylpyrrolidine-1-carbonyl]amino]propan-2-yl]azanium
CID 53350242
1-(2-Thiophen-2-ylethyl)-3-(2,4,4-trimethylpentan-2-yl)urea
CID 3738612
1-(2-Thiophen-2-ylethyl)-3-[2-(thiophen-2-ylmethylsulfanyl)ethyl]urea
CID 40035030
1-[1-(2-Thiophen-2-ylethyl)piperidin-4-yl]imidazolidin-2-one
CID 53622057
1-(2-Ethylsulfonylethyl)-3-[1-(5-methylthiophen-2-yl)ethyl]urea
CID 71933688
1-Propyl-3-(2-thiophen-2-ylethyl)urea
CID 74229353

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea?
The IUPAC name of 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea (CID 17174400) is 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea.
What is the SMILES notation for 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea?
The canonical SMILES for 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea is O=C(NCc1cccs1)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea?
The InChIKey is ZMTCIGPBNIYFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c14-11(13-9-4-1-2-5-9)12-8-10-6-3-7-15-10/h3,6-7,9H,1-2,4-5,8H2,(H2,12,13,14).
What are the key properties of 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea?
1-cyclopentyl-3-(thiophen-2-ylmethyl)urea has a molecular weight of 224.33 g/mol, XLogP of 2.49, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(thiophen-2-ylmethyl)urea is sourced from PubChem (CID 17174400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).