1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine

C14H23NS — CID 107188789

IUPAC1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine
SMILESCC1(C)CCCC1C(N)CCc1ccsc1
InChIInChI=1S/C14H23NS/c1-14(2)8-3-4-12(14)13(15)6-5-11-7-9-16-10-11/h7,9-10,12-13H,3-6,8,15H2,1-2H3
InChIKeyKQBGJJXQLPDTSG-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.83
Rot. Bonds4

About 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine

1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine (PubChem CID 107188789) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine.

Molecular Properties

Compound Name1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine
PubChem CID107188789
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC Name1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine
SMILESCC1(C)CCCC1C(N)CCc1ccsc1
InChIInChI=1S/C14H23NS/c1-14(2)8-3-4-12(14)13(15)6-5-11-7-9-16-10-11/h7,9-10,12-13H,3-6,8,15H2,1-2H3
InChIKeyKQBGJJXQLPDTSG-UHFFFAOYSA-N
XLogP3.83
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-dimethylcyclopentyl)-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 107188788
1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine
CID 115856867
1-(thian-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 80626558
1-(5-methyloxolan-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 115856877
1-(1-amino-3-thiophen-3-ylpropyl)-N,N,3-trimethylcyclohexan-1-amine
CID 79074834
1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
CID 65423572
1-(1-methylcyclopentyl)-3-thiophen-3-ylpropan-1-ol
CID 115798476
1-(3-methyl-1,4-dithian-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 115386725
1-(2,2-dimethylcyclopentyl)-2-thiophen-2-ylethanamine
CID 107179421
1-(1-ethoxy-3-methylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
CID 116768130
1-cyclopentyl-5-thiophen-3-ylpentan-3-amine
CID 115857138
1-(2,3-dihydro-1H-inden-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 65409928

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine?
The IUPAC name of 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine (CID 107188789) is 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine.
What is the SMILES notation for 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine?
The canonical SMILES for 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine is CC1(C)CCCC1C(N)CCc1ccsc1.
What is the InChIKey of 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine?
The InChIKey is KQBGJJXQLPDTSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-14(2)8-3-4-12(14)13(15)6-5-11-7-9-16-10-11/h7,9-10,12-13H,3-6,8,15H2,1-2H3.
What are the key properties of 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine?
1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine has a molecular weight of 237.41 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine is sourced from PubChem (CID 107188789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).