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

C10H21NS — CID 63278127

IUPAC2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine
SMILESCSCCCNC1CCCC1C
InChIInChI=1S/C10H21NS/c1-9-5-3-6-10(9)11-7-4-8-12-2/h9-11H,3-8H2,1-2H3
InChIKeyPRTCWZKPGGSKDU-UHFFFAOYSA-N
MW187.35 g/mol
LogP2.52
Rot. Bonds5

About 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine

2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine (PubChem CID 63278127) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine
PubChem CID63278127
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Name2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine
SMILESCSCCCNC1CCCC1C
InChIInChI=1S/C10H21NS/c1-9-5-3-6-10(9)11-7-4-8-12-2/h9-11H,3-8H2,1-2H3
InChIKeyPRTCWZKPGGSKDU-UHFFFAOYSA-N
XLogP2.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 52.52
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

2-methyl-N-(3-methylsulfanylpropyl)cyclopropan-1-amine
CID 62399111
trans-(1R,2R)-2-(3-methylsulfanylpropylamino)cyclopentan-1-ol
CID 102733502
6-[(2-methylcyclopentyl)amino]hexan-1-ol
CID 115906759
N',N'-dimethyl-N-[(1R,2S)-2-methylcyclopentyl]propane-1,3-diamine
CID 96923135
trans-(1R,2R)-N-(3-methoxypropyl)-2-methylcyclopentan-1-amine
CID 95377511
2-cyclohexyl-N-(3-methylsulfanylpropyl)cyclohexan-1-amine
CID 63983395
N-hex-5-ynyl-2-methylcyclopentan-1-amine
CID 115694131
N-(2-tert-butylsulfanylethyl)-2-methylcyclopentan-1-amine
CID 115689067
cis-(1R,2S)-N-(4-methoxybutyl)-2-methylcyclopentan-1-amine
CID 96923239
trans-(1R,2R)-N-(4-methoxybutyl)-2-methylcyclopentan-1-amine
CID 96923238
trans-(1R,2R)-2-(4-methylsulfanylbutylamino)cyclohexan-1-ol
CID 102731704
N-(3-methylsulfanylpropyl)cyclopropanamine
CID 28607191

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine?
The IUPAC name of 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine (CID 63278127) is 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine.
What is the SMILES notation for 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine?
The canonical SMILES for 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine is CSCCCNC1CCCC1C.
What is the InChIKey of 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine?
The InChIKey is PRTCWZKPGGSKDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NS/c1-9-5-3-6-10(9)11-7-4-8-12-2/h9-11H,3-8H2,1-2H3.
What are the key properties of 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine?
2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine has a molecular weight of 187.35 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-methylsulfanylpropyl)cyclopentan-1-amine is sourced from PubChem (CID 63278127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).