1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine

C12H19NS — CID 115706476

IUPAC1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine
SMILESCC(NCCc1cccs1)C1CCC1
InChIInChI=1S/C12H19NS/c1-10(11-4-2-5-11)13-8-7-12-6-3-9-14-12/h3,6,9-11,13H,2,4-5,7-8H2,1H3
InChIKeyWROHOJQAFMUFBF-UHFFFAOYSA-N
MW209.36 g/mol
LogP3.07
Rot. Bonds5

About 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine

1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine (PubChem CID 115706476) has the molecular formula C12H19NS and a molecular weight of 209.36 g/mol. Its IUPAC name is 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine
PubChem CID115706476
Molecular FormulaC12H19NS
Molecular Weight209.36 g/mol
Exact Mass209.12
IUPAC Name1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine
SMILESCC(NCCc1cccs1)C1CCC1
InChIInChI=1S/C12H19NS/c1-10(11-4-2-5-11)13-8-7-12-6-3-9-14-12/h3,6,9-11,13H,2,4-5,7-8H2,1H3
InChIKeyWROHOJQAFMUFBF-UHFFFAOYSA-N
XLogP3.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.36
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine 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

(1R)-1-cyclopentyl-N-(2-thiophen-2-ylethyl)ethanamine
CID 81395803
N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine
CID 115897402
1-cyclohexyl-N-(thiophen-2-ylmethyl)ethanamine
CID 43769306
1-cyclohexyl-N-(thiophen-2-ylmethyl)ethanamine;hydrochloride
CID 69253507
N-(1-cyclopropylethyl)-N'-propan-2-yl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 62558541
1-cyclohexyl-N-(2-thiophen-2-ylethyl)propan-1-amine
CID 55234964
1-(1-ethylpiperidin-4-yl)-N-(thiophen-2-ylmethyl)ethanamine
CID 43308376
1-(1-methylpiperidin-4-yl)-N-(thiophen-2-ylmethyl)ethanamine
CID 43308377
3-(2-methylpropyl)-N-(2-thiophen-2-ylethyl)cyclohexan-1-amine
CID 107427921
N-(1-cyclopentylethyl)-2-thiophen-2-ylpropan-1-amine
CID 115722143
1-chloro-N-(2-thiophen-2-ylethyl)propan-2-amine
CID 65025687
1-cyclobutyl-N-ethyl-4-thiophen-2-ylbutan-2-amine
CID 103168700

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine?
The IUPAC name of 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine (CID 115706476) is 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine.
What is the SMILES notation for 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine?
The canonical SMILES for 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine is CC(NCCc1cccs1)C1CCC1.
What is the InChIKey of 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine?
The InChIKey is WROHOJQAFMUFBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NS/c1-10(11-4-2-5-11)13-8-7-12-6-3-9-14-12/h3,6,9-11,13H,2,4-5,7-8H2,1H3.
What are the key properties of 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine?
1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine has a molecular weight of 209.36 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine is sourced from PubChem (CID 115706476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).