1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine

C12H19NS — CID 63247754

IUPAC1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine
SMILESCC(NCc1ccsc1)C1CCCC1
InChIInChI=1S/C12H19NS/c1-10(12-4-2-3-5-12)13-8-11-6-7-14-9-11/h6-7,9-10,12-13H,2-5,8H2,1H3
InChIKeyBHXGYOQGAKTKHN-UHFFFAOYSA-N
MW209.36 g/mol
LogP3.42
Rot. Bonds4

About 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine

1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine (PubChem CID 63247754) has the molecular formula C12H19NS and a molecular weight of 209.36 g/mol. Its IUPAC name is 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine
PubChem CID63247754
Molecular FormulaC12H19NS
Molecular Weight209.36 g/mol
Exact Mass209.12
IUPAC Name1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine
SMILESCC(NCc1ccsc1)C1CCCC1
InChIInChI=1S/C12H19NS/c1-10(12-4-2-3-5-12)13-8-11-6-7-14-9-11/h6-7,9-10,12-13H,2-5,8H2,1H3
InChIKeyBHXGYOQGAKTKHN-UHFFFAOYSA-N
XLogP3.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.36
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-cyclopentyl-N-[(4-ethylphenyl)methyl]ethanamine
CID 81386101
(1R)-1-cyclopentyl-N-[(4-methylphenyl)methyl]ethanamine
CID 81394920
4-propan-2-yl-N-(thiophen-3-ylmethyl)cyclohexan-1-amine
CID 63247711
(1S)-1-cyclohexyl-N-[(4-ethylphenyl)methyl]ethanamine
CID 81387895
(1S)-1-cycloheptyl-N-[(4-propan-2-ylphenyl)methyl]ethanamine
CID 81390306
(1R)-N-[(4-bromophenyl)methyl]-1-cyclohexylethanamine
CID 81384290
(1R)-1-cycloheptyl-N-[(4-propan-2-ylphenyl)methyl]ethanamine
CID 81388470
1-cyclopropyl-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]ethanamine
CID 115676262
(1S)-1-cyclobutyl-N-[(4-methylphenyl)methyl]ethanamine
CID 118957385
(1R)-1-cyclopentyl-N-[(3,5-dimethylphenyl)methyl]ethanamine
CID 81395487
(1S)-1-cyclopentyl-N-[(3,5-dimethylphenyl)methyl]ethanamine
CID 81386110
1-cyclohexyl-N-(thiophen-2-ylmethyl)ethanamine
CID 43769306

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine?
The IUPAC name of 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine (CID 63247754) is 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine?
The canonical SMILES for 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine is CC(NCc1ccsc1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine?
The InChIKey is BHXGYOQGAKTKHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NS/c1-10(12-4-2-3-5-12)13-8-11-6-7-14-9-11/h6-7,9-10,12-13H,2-5,8H2,1H3.
What are the key properties of 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine?
1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine has a molecular weight of 209.36 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(thiophen-3-ylmethyl)ethanamine is sourced from PubChem (CID 63247754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).