3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine

C10H21NS — CID 116538737

IUPAC3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine
SMILESCSCCCC1(C)CCC(N)C1
InChIInChI=1S/C10H21NS/c1-10(5-3-7-12-2)6-4-9(11)8-10/h9H,3-8,11H2,1-2H3
InChIKeyFGIWELMRXVQUSC-UHFFFAOYSA-N
MW187.35 g/mol
LogP2.65
Rot. Bonds4

About 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine

3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine (PubChem CID 116538737) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine
PubChem CID116538737
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Name3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine
SMILESCSCCCC1(C)CCC(N)C1
InChIInChI=1S/C10H21NS/c1-10(5-3-7-12-2)6-4-9(11)8-10/h9H,3-8,11H2,1-2H3
InChIKeyFGIWELMRXVQUSC-UHFFFAOYSA-N
XLogP2.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-methyl-1-(3-methylsulfanylpropyl)cyclopentane
CID 22095061
3-but-3-enyl-3-methylcyclopentan-1-amine
CID 116538762
3-methyl-3-(2-methylbutyl)cyclopentan-1-amine
CID 116538708
3-methyl-3-(oxan-4-ylmethyl)cyclopentan-1-amine
CID 116538676
3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-one
CID 116538551
3-methyl-3-[2-(1-methylimidazol-2-yl)ethyl]cyclopentan-1-amine
CID 114532157
1-butyl-1,3-dimethylcyclopentane
CID 123273889
4-(3-ethyl-1-methylcyclopentyl)butanamide
CID 91504691
3-methyl-3-(pyridin-4-ylmethyl)cyclopentan-1-amine
CID 116538767
3-methyl-3-[(2-propyl-1,2,4-triazol-3-yl)methyl]cyclopentan-1-amine
CID 116538769
3-methyl-3-propylbicyclo[4.2.0]octane
CID 148753251
3-[(3,4-dichlorophenyl)methyl]-3-methylcyclopentan-1-amine
CID 116538677

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine?
The IUPAC name of 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine (CID 116538737) is 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine?
The canonical SMILES for 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine is CSCCCC1(C)CCC(N)C1.
What is the InChIKey of 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine?
The InChIKey is FGIWELMRXVQUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NS/c1-10(5-3-7-12-2)6-4-9(11)8-10/h9H,3-8,11H2,1-2H3.
What are the key properties of 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine?
3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine has a molecular weight of 187.35 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(3-methylsulfanylpropyl)cyclopentan-1-amine is sourced from PubChem (CID 116538737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).