2-(3-methylbutylsulfinyl)cyclopentan-1-amine

C10H21NOS — CID 107760700

IUPAC2-(3-methylbutylsulfinyl)cyclopentan-1-amine
SMILESCC(C)CCS(=O)C1CCCC1N
InChIInChI=1S/C10H21NOS/c1-8(2)6-7-13(12)10-5-3-4-9(10)11/h8-10H,3-7,11H2,1-2H3
InChIKeyQFSIKJZVUDABPJ-UHFFFAOYSA-N
MW203.35 g/mol
LogP1.66
Rot. Bonds4

About 2-(3-methylbutylsulfinyl)cyclopentan-1-amine

2-(3-methylbutylsulfinyl)cyclopentan-1-amine (PubChem CID 107760700) has the molecular formula C10H21NOS and a molecular weight of 203.35 g/mol. Its IUPAC name is 2-(3-methylbutylsulfinyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(3-methylbutylsulfinyl)cyclopentan-1-amine
PubChem CID107760700
Molecular FormulaC10H21NOS
Molecular Weight203.35 g/mol
Exact Mass203.13
IUPAC Name2-(3-methylbutylsulfinyl)cyclopentan-1-amine
SMILESCC(C)CCS(=O)C1CCCC1N
InChIInChI=1S/C10H21NOS/c1-8(2)6-7-13(12)10-5-3-4-9(10)11/h8-10H,3-7,11H2,1-2H3
InChIKeyQFSIKJZVUDABPJ-UHFFFAOYSA-N
XLogP1.66
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.35
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-Methylpropylsulfanyl)cyclopentan-1-amine
CID 64610077
1-Ethylsulfinyl-2-methylpentan-3-amine
CID 142226257
2-Tert-butylsulfonylcyclopentan-1-amine
CID 174320345
2-(2-Methylsulfonylethylsulfanyl)cyclopentan-1-amine
CID 64609409
2-(2-Methylpropylsulfonyl)cyclopentan-1-amine
CID 64645430
2-Butan-2-ylsulfonylcyclopentan-1-amine
CID 64646489
2-(Propane-1-sulfonyl)cyclopentan-1-amine
CID 64646493
6-(2-Methylpropylsulfinyl)hexan-2-amine
CID 64650803
N-methyl-2-(2-methylpropylsulfinyl)cyclopentan-1-amine
CID 64650814
2-(2-Methylpropylsulfinyl)cyclopentan-1-amine
CID 64651234
2-tert-butylsulfinyl-N-propylcyclopentan-1-amine
CID 64651314
N-methyl-2-propylsulfinylcyclopentan-1-amine
CID 64651543

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylbutylsulfinyl)cyclopentan-1-amine?
The IUPAC name of 2-(3-methylbutylsulfinyl)cyclopentan-1-amine (CID 107760700) is 2-(3-methylbutylsulfinyl)cyclopentan-1-amine.
What is the SMILES notation for 2-(3-methylbutylsulfinyl)cyclopentan-1-amine?
The canonical SMILES for 2-(3-methylbutylsulfinyl)cyclopentan-1-amine is CC(C)CCS(=O)C1CCCC1N.
What is the InChIKey of 2-(3-methylbutylsulfinyl)cyclopentan-1-amine?
The InChIKey is QFSIKJZVUDABPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NOS/c1-8(2)6-7-13(12)10-5-3-4-9(10)11/h8-10H,3-7,11H2,1-2H3.
What are the key properties of 2-(3-methylbutylsulfinyl)cyclopentan-1-amine?
2-(3-methylbutylsulfinyl)cyclopentan-1-amine has a molecular weight of 203.35 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylbutylsulfinyl)cyclopentan-1-amine is sourced from PubChem (CID 107760700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).