N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine

C14H23NS — CID 115897402

IUPACN-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine
SMILESCC(NCCCc1cccs1)C1CCCC1
InChIInChI=1S/C14H23NS/c1-12(13-6-2-3-7-13)15-10-4-8-14-9-5-11-16-14/h5,9,11-13,15H,2-4,6-8,10H2,1H3
InChIKeyDGWFLRIQERJWKS-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.85
Rot. Bonds6

About N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine

N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine (PubChem CID 115897402) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound NameN-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine
PubChem CID115897402
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC NameN-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine
SMILESCC(NCCCc1cccs1)C1CCCC1
InChIInChI=1S/C14H23NS/c1-12(13-6-2-3-7-13)15-10-4-8-14-9-5-11-16-14/h5,9,11-13,15H,2-4,6-8,10H2,1H3
InChIKeyDGWFLRIQERJWKS-UHFFFAOYSA-N
XLogP3.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-cyclopentyl-N-(2-thiophen-2-ylethyl)ethanamine
CID 81395803
1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine
CID 115706476
1-cyclohexyl-N-(thiophen-2-ylmethyl)ethanamine
CID 43769306
1-cyclohexyl-N-(thiophen-2-ylmethyl)ethanamine;hydrochloride
CID 69253507
3-methyl-N-(3-thiophen-2-ylpropyl)butan-2-amine
CID 115897426
N-propan-2-yl-6-thiophen-2-ylhexan-1-amine
CID 65308474
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-N-cyclopropyl-2-N-(4-thiophen-2-ylbutyl)propane-1,2-diamine
CID 113407448
N-(1-cyclopentylethyl)-2-thiophen-2-ylpropan-1-amine
CID 115722143
1-(1-ethylpiperidin-4-yl)-N-(thiophen-2-ylmethyl)ethanamine
CID 43308376
N-(3-thiophen-2-ylpropyl)hexan-2-amine
CID 115897415

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine?
The IUPAC name of N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine (CID 115897402) is N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine?
The canonical SMILES for N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine is CC(NCCCc1cccs1)C1CCCC1.
What is the InChIKey of N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine?
The InChIKey is DGWFLRIQERJWKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-12(13-6-2-3-7-13)15-10-4-8-14-9-5-11-16-14/h5,9,11-13,15H,2-4,6-8,10H2,1H3.
What are the key properties of N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine?
N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine has a molecular weight of 237.41 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 115897402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).