1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine

C13H19NS — CID 115856867

IUPAC1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine
SMILESNC(CCc1ccsc1)C1C2CCCC21
InChIInChI=1S/C13H19NS/c14-12(5-4-9-6-7-15-8-9)13-10-2-1-3-11(10)13/h6-8,10-13H,1-5,14H2
InChIKeyUFHZTZAYFZWBFJ-UHFFFAOYSA-N
MW221.37 g/mol
LogP3.05
Rot. Bonds4

About 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine

1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine (PubChem CID 115856867) has the molecular formula C13H19NS and a molecular weight of 221.37 g/mol. Its IUPAC name is 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine.

Molecular Properties

Compound Name1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine
PubChem CID115856867
Molecular FormulaC13H19NS
Molecular Weight221.37 g/mol
Exact Mass221.12
IUPAC Name1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine
SMILESNC(CCc1ccsc1)C1C2CCCC21
InChIInChI=1S/C13H19NS/c14-12(5-4-9-6-7-15-8-9)13-10-2-1-3-11(10)13/h6-8,10-13H,1-5,14H2
InChIKeyUFHZTZAYFZWBFJ-UHFFFAOYSA-N
XLogP3.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.37
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine with MolForge

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Related Compounds

1-(thian-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 80626558
1-(2,2-dimethylcyclopentyl)-3-thiophen-3-ylpropan-1-amine
CID 107188789
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-(5-methyloxolan-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 115856877
1-(4-propylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
CID 65423572
1-(1,1-dioxothiolan-3-yl)-3-thiophen-3-ylpropan-1-amine
CID 65020401
1-(3-methyl-1,4-dithian-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 115386725
1-(4-methylthiomorpholin-3-yl)-3-thiophen-3-ylpropan-1-amine
CID 106444474
1-(1,4-dioxan-2-yl)-3-thiophen-3-ylpropan-1-amine
CID 65351038
1-cyclopropyl-3-thiophen-3-ylpropan-1-ol
CID 63354651
1-cyclopropyl-1-methoxy-4-thiophen-3-ylbutan-2-amine
CID 116722043

Frequently Asked Questions

What is the IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine?
The IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine (CID 115856867) is 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine.
What is the SMILES notation for 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine?
The canonical SMILES for 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine is NC(CCc1ccsc1)C1C2CCCC21.
What is the InChIKey of 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine?
The InChIKey is UFHZTZAYFZWBFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NS/c14-12(5-4-9-6-7-15-8-9)13-10-2-1-3-11(10)13/h6-8,10-13H,1-5,14H2.
What are the key properties of 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine?
1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine has a molecular weight of 221.37 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bicyclo[3.1.0]hexanyl)-3-thiophen-3-ylpropan-1-amine is sourced from PubChem (CID 115856867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).