2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine

C10H21NS — CID 107747108

IUPAC2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine
SMILESCC(C)C(C)SC1CCCC1N
InChIInChI=1S/C10H21NS/c1-7(2)8(3)12-10-6-4-5-9(10)11/h7-10H,4-6,11H2,1-3H3
InChIKeyNVJUJBUOJQJJRN-UHFFFAOYSA-N
MW187.35 g/mol
LogP2.64
Rot. Bonds3

About 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine

2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine (PubChem CID 107747108) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine
PubChem CID107747108
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Name2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine
SMILESCC(C)C(C)SC1CCCC1N
InChIInChI=1S/C10H21NS/c1-7(2)8(3)12-10-6-4-5-9(10)11/h7-10H,4-6,11H2,1-3H3
InChIKeyNVJUJBUOJQJJRN-UHFFFAOYSA-N
XLogP2.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-ylsulfanylcyclopentan-1-amine
CID 64613407
2-methyl-3-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine
CID 107763462
2-(4-aminobutan-2-ylsulfanyl)cyclohexan-1-amine
CID 106440988
3-(2-aminocyclooctyl)sulfanylbutan-1-ol
CID 66138218
2-(3-methylbutan-2-ylsulfanyl)cycloheptane-1-carboxylic acid
CID 107760783
2-cyclopentylsulfanylcyclopentan-1-amine
CID 64627939
2-cyclohexylsulfanylcyclopentan-1-amine
CID 64632243
2-(2-aminoethylsulfanyl)cyclopentan-1-amine
CID 80662216
trans-(1R,2S)-2-propan-2-ylcyclohexan-1-amine;hydrochloride
CID 169426294
3-(2-amino-5,5-dimethylcyclohexyl)sulfanylbutan-2-ol
CID 107772656
cis-(1R,2S)-cyclopentane-1,2-diamine;dihydrochloride
CID 66730598
platinum;trans-(1R,2R)-cyclopentane-1,2-diamine
CID 87290141

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine?
The IUPAC name of 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine (CID 107747108) is 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine.
What is the SMILES notation for 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine?
The canonical SMILES for 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine is CC(C)C(C)SC1CCCC1N.
What is the InChIKey of 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine?
The InChIKey is NVJUJBUOJQJJRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NS/c1-7(2)8(3)12-10-6-4-5-9(10)11/h7-10H,4-6,11H2,1-3H3.
What are the key properties of 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine?
2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine has a molecular weight of 187.35 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylbutan-2-ylsulfanyl)cyclopentan-1-amine is sourced from PubChem (CID 107747108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).