2-cyclopentyl-2-ethylsulfanylethanamine

C9H19NS — CID 82931270

IUPAC2-cyclopentyl-2-ethylsulfanylethanamine
SMILESCCSC(CN)C1CCCC1
InChIInChI=1S/C9H19NS/c1-2-11-9(7-10)8-5-3-4-6-8/h8-9H,2-7,10H2,1H3
InChIKeyCJJMNGNTFMYUPE-UHFFFAOYSA-N
MW173.32 g/mol
LogP2.26
Rot. Bonds4

About 2-cyclopentyl-2-ethylsulfanylethanamine

2-cyclopentyl-2-ethylsulfanylethanamine (PubChem CID 82931270) has the molecular formula C9H19NS and a molecular weight of 173.32 g/mol. Its IUPAC name is 2-cyclopentyl-2-ethylsulfanylethanamine.

Molecular Properties

Compound Name2-cyclopentyl-2-ethylsulfanylethanamine
PubChem CID82931270
Molecular FormulaC9H19NS
Molecular Weight173.32 g/mol
Exact Mass173.12
IUPAC Name2-cyclopentyl-2-ethylsulfanylethanamine
SMILESCCSC(CN)C1CCCC1
InChIInChI=1S/C9H19NS/c1-2-11-9(7-10)8-5-3-4-6-8/h8-9H,2-7,10H2,1H3
InChIKeyCJJMNGNTFMYUPE-UHFFFAOYSA-N
XLogP2.26
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.32
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cycloheptyl-2-(2-methylpropylsulfanyl)ethanamine
CID 82932340
2-cycloheptyl-2-cyclohexylsulfanylethanamine
CID 82931571
2-amino-1-cyclopentylethanethiol
CID 116868701
2-cyclohexyl-2-(3-methylphenyl)sulfanylethanamine
CID 82931065
(2S)-2-cycloheptylpropan-1-amine
CID 96634967
2-cyclopentyloctan-1-amine
CID 112569591
2-cyclopentyl-2-(4-fluorophenyl)sulfanylethanamine
CID 82932342
(1S)-1-cyclopentylethane-1,2-diamine
CID 55292792
2-cyclohexylpropan-1-amine;hydrochloride
CID 24837056
2-(2-chlorophenyl)sulfanyl-2-cyclohexylethanamine
CID 82931377
propane;propan-2-ylcyclopentane
CID 91615250
(2S)-2-cyclohexyl-3-methylbutan-1-amine
CID 96739435

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-ethylsulfanylethanamine?
The IUPAC name of 2-cyclopentyl-2-ethylsulfanylethanamine (CID 82931270) is 2-cyclopentyl-2-ethylsulfanylethanamine.
What is the SMILES notation for 2-cyclopentyl-2-ethylsulfanylethanamine?
The canonical SMILES for 2-cyclopentyl-2-ethylsulfanylethanamine is CCSC(CN)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-2-ethylsulfanylethanamine?
The InChIKey is CJJMNGNTFMYUPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NS/c1-2-11-9(7-10)8-5-3-4-6-8/h8-9H,2-7,10H2,1H3.
What are the key properties of 2-cyclopentyl-2-ethylsulfanylethanamine?
2-cyclopentyl-2-ethylsulfanylethanamine has a molecular weight of 173.32 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-ethylsulfanylethanamine is sourced from PubChem (CID 82931270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).