2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine

C13H25NS — CID 79576536

IUPAC2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine
SMILESNC1CCCC1CCSC1CCCCC1
InChIInChI=1S/C13H25NS/c14-13-8-4-5-11(13)9-10-15-12-6-2-1-3-7-12/h11-13H,1-10,14H2
InChIKeyUZABLZKXTBRICK-UHFFFAOYSA-N
MW227.42 g/mol
LogP3.57
Rot. Bonds4

About 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine

2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine (PubChem CID 79576536) has the molecular formula C13H25NS and a molecular weight of 227.42 g/mol. Its IUPAC name is 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine
PubChem CID79576536
Molecular FormulaC13H25NS
Molecular Weight227.42 g/mol
Exact Mass227.17
IUPAC Name2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine
SMILESNC1CCCC1CCSC1CCCCC1
InChIInChI=1S/C13H25NS/c14-13-8-4-5-11(13)9-10-15-12-6-2-1-3-7-12/h11-13H,1-10,14H2
InChIKeyUZABLZKXTBRICK-UHFFFAOYSA-N
XLogP3.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.42
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-cyclohexylsulfanylethyl)-N-propylcyclopentan-1-amine
CID 79576187
N-[2-(2-aminocyclopentyl)ethyl]-N-methylcyclohexanamine
CID 79569478
2-cyclopentylsulfanylethanamine
CID 23401603
3-[2-(2-aminocyclopentyl)ethylsulfanyl]propan-1-ol
CID 79576201
2-cyclohexylsulfanylethanethiol
CID 12594005
2-(2-cyclopropylethyl)cyclopentan-1-amine
CID 138461758
2-cyclohexylsulfanyl-N-methylethanamine
CID 46741497
cyclohexylsulfanylmethanamine
CID 18729999
4-cyclopentylsulfanylbutylcyclohexane
CID 166876446
2-[2-(3-methoxypropylsulfanyl)ethyl]cyclopentan-1-amine
CID 79577369
2-(2-cyclohexylsulfonylethyl)cyclopentan-1-amine
CID 79581966
propylsulfanylcyclopentane
CID 534899

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine?
The IUPAC name of 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine (CID 79576536) is 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine.
What is the SMILES notation for 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine?
The canonical SMILES for 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine is NC1CCCC1CCSC1CCCCC1.
What is the InChIKey of 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine?
The InChIKey is UZABLZKXTBRICK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NS/c14-13-8-4-5-11(13)9-10-15-12-6-2-1-3-7-12/h11-13H,1-10,14H2.
What are the key properties of 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine?
2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine has a molecular weight of 227.42 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexylsulfanylethyl)cyclopentan-1-amine is sourced from PubChem (CID 79576536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).