1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine

C15H25NS — CID 107412059

IUPAC1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine
SMILESCCc1ccc(C(C)NCC2CCC(C)C2)s1
InChIInChI=1S/C15H25NS/c1-4-14-7-8-15(17-14)12(3)16-10-13-6-5-11(2)9-13/h7-8,11-13,16H,4-6,9-10H2,1-3H3
InChIKeyHTIRREYGUQVDEU-UHFFFAOYSA-N
MW251.44 g/mol
LogP4.40
Rot. Bonds5

About 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine

1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine (PubChem CID 107412059) has the molecular formula C15H25NS and a molecular weight of 251.44 g/mol. Its IUPAC name is 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine.

Molecular Properties

Compound Name1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine
PubChem CID107412059
Molecular FormulaC15H25NS
Molecular Weight251.44 g/mol
Exact Mass251.17
IUPAC Name1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine
SMILESCCc1ccc(C(C)NCC2CCC(C)C2)s1
InChIInChI=1S/C15H25NS/c1-4-14-7-8-15(17-14)12(3)16-10-13-6-5-11(2)9-13/h7-8,11-13,16H,4-6,9-10H2,1-3H3
InChIKeyHTIRREYGUQVDEU-UHFFFAOYSA-N
XLogP4.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.44
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]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

1-(5-ethylthiophen-2-yl)-N-[(2-methylcyclopropyl)methyl]ethanamine
CID 115713093
1-(5-ethylthiophen-2-yl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]ethanamine
CID 61335739
(1R)-1-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 55277214
1-(4-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine
CID 107411910
ethyl 2-(cyclopropylmethylamino)-2-(5-ethylthiophen-2-yl)acetate
CID 62345226
N-[(3-methylcyclopentyl)methyl]-1-(2-methylphenyl)ethanamine
CID 107411455
1-(5-ethylthiophen-2-yl)-N-[(1-methylcyclopropyl)methyl]ethanamine
CID 103902899
1-(5-bromothiophen-2-yl)-N-[(4-ethylcyclohexyl)methyl]ethanamine
CID 63451995
N-[1-(5-ethylthiophen-2-yl)ethyl]-2-methyloxolan-3-amine
CID 82725149
1-(2-fluorophenyl)-N-[(3-methylcyclopentyl)methyl]ethanamine
CID 107411471
1-(2-bicyclo[2.2.1]heptanyl)-N-[1-(5-ethylthiophen-2-yl)ethyl]ethanamine
CID 63422667
N-cyclopropyl-2-[1-(5-ethylthiophen-2-yl)ethylamino]acetamide
CID 61333566

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
The IUPAC name of 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine (CID 107412059) is 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine.
What is the SMILES notation for 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
The canonical SMILES for 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine is CCc1ccc(C(C)NCC2CCC(C)C2)s1.
What is the InChIKey of 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
The InChIKey is HTIRREYGUQVDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NS/c1-4-14-7-8-15(17-14)12(3)16-10-13-6-5-11(2)9-13/h7-8,11-13,16H,4-6,9-10H2,1-3H3.
What are the key properties of 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine?
1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine has a molecular weight of 251.44 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylthiophen-2-yl)-N-[(3-methylcyclopentyl)methyl]ethanamine is sourced from PubChem (CID 107412059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).