1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine

C16H27NS — CID 65423572

IUPAC1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
SMILESCCCC1CCC(C(N)CCc2ccsc2)CC1
InChIInChI=1S/C16H27NS/c1-2-3-13-4-7-15(8-5-13)16(17)9-6-14-10-11-18-12-14/h10-13,15-16H,2-9,17H2,1H3
InChIKeyLNKUQBRYLKQSQF-UHFFFAOYSA-N
MW265.47 g/mol
LogP4.61
Rot. Bonds6

About 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine

1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine (PubChem CID 65423572) has the molecular formula C16H27NS and a molecular weight of 265.47 g/mol. Its IUPAC name is 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine.

Molecular Properties

Compound Name1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
PubChem CID65423572
Molecular FormulaC16H27NS
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC Name1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
SMILESCCCC1CCC(C(N)CCc2ccsc2)CC1
InChIInChI=1S/C16H27NS/c1-2-3-13-4-7-15(8-5-13)16(17)9-6-14-10-11-18-12-14/h10-13,15-16H,2-9,17H2,1H3
InChIKeyLNKUQBRYLKQSQF-UHFFFAOYSA-N
XLogP4.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.47
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-cyclopropylethyl)thiophene
CID 159324839
1-(2,3-dihydro-1H-inden-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 65409928
1-cyclopentyl-5-thiophen-3-ylpentan-3-amine
CID 115857138
1-(1,1-dioxothiolan-3-yl)-3-thiophen-3-ylpropan-1-amine
CID 65020401
1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine
CID 115856867
1-cyclopropyl-1-methoxy-4-thiophen-3-ylbutan-2-amine
CID 116722043
1-(5-methyloxolan-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 115856877
1-cyclopropyl-3-thiophen-3-ylpropan-1-ol
CID 63354651
1-(3-ethylcyclopentyl)-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 65411999
1-cyclopropyl-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 63354899
2-(4-bromothiophen-2-yl)-1-(4-propylcyclohexyl)ethanamine
CID 65425884
1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine
CID 107188789

Frequently Asked Questions

What is the IUPAC name of 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine?
The IUPAC name of 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine (CID 65423572) is 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine.
What is the SMILES notation for 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine?
The canonical SMILES for 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine is CCCC1CCC(C(N)CCc2ccsc2)CC1.
What is the InChIKey of 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine?
The InChIKey is LNKUQBRYLKQSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NS/c1-2-3-13-4-7-15(8-5-13)16(17)9-6-14-10-11-18-12-14/h10-13,15-16H,2-9,17H2,1H3.
What are the key properties of 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine?
1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine has a molecular weight of 265.47 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine is sourced from PubChem (CID 65423572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).