1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine

C13H21NS — CID 115860707

IUPAC1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
SMILESCC1(C(N)CCc2cccs2)CCCC1
InChIInChI=1S/C13H21NS/c1-13(8-2-3-9-13)12(14)7-6-11-5-4-10-15-11/h4-5,10,12H,2-3,6-9,14H2,1H3
InChIKeyQDHNKYAOQLNKAT-UHFFFAOYSA-N
MW223.38 g/mol
LogP3.59
Rot. Bonds4

About 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine

1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine (PubChem CID 115860707) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
PubChem CID115860707
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC Name1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
SMILESCC1(C(N)CCc2cccs2)CCCC1
InChIInChI=1S/C13H21NS/c1-13(8-2-3-9-13)12(14)7-6-11-5-4-10-15-11/h4-5,10,12H,2-3,6-9,14H2,1H3
InChIKeyQDHNKYAOQLNKAT-UHFFFAOYSA-N
XLogP3.59
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-methylcyclohexyl)-3-thiophen-2-ylpropan-1-ol
CID 106830888
1-(1-pyrrolidin-1-ylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 79057434
1-(1-piperidin-1-ylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 79059762
1-(1-ethylcyclopentyl)-3-thiophen-2-ylpropan-1-ol
CID 115800364
1-(2-thiophen-2-ylethyl)cyclopentan-1-amine
CID 63774974
1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine
CID 79066955
2-ethyl-4-thiophen-2-ylbutan-1-amine
CID 63774088
1-(2-methylcyclopropyl)-3-thiophen-2-ylpropan-1-amine
CID 65422765
4-methyl-4-pyrrolidin-1-yl-1-thiophen-2-ylpentan-3-amine
CID 79056548
N-ethyl-1-(1-methoxycyclohexyl)-3-thiophen-2-ylpropan-1-amine
CID 116763172
2-propan-2-yl-2-(2-thiophen-2-ylethyl)azepane
CID 79119111
3-methyl-5-thiophen-2-ylpentan-1-amine
CID 65300701

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine?
The IUPAC name of 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine (CID 115860707) is 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine?
The canonical SMILES for 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine is CC1(C(N)CCc2cccs2)CCCC1.
What is the InChIKey of 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine?
The InChIKey is QDHNKYAOQLNKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-13(8-2-3-9-13)12(14)7-6-11-5-4-10-15-11/h4-5,10,12H,2-3,6-9,14H2,1H3.
What are the key properties of 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine?
1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine has a molecular weight of 223.38 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 115860707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).