2-Methylcyclopentylamine

HCID 409747

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Basic information

CAS: 41223-14-7
Standard SMILES: CC1CCCC1N
InChIKey: TYDMZADCGUWTCH-UHFFFAOYSA-N
Molecular formula: C6H13N
Average molar mass: 99.17 g/mol
Monoisotopic mass: 99.10479942

Names & identifiers

Preferred name: 2-Methylcyclopentylamine
IUPAC: 2-methylcyclopentan-1-amine
English name: 2-Methyl CyclopentanaMine
Molecular formula: C6H13N
Molecular weight: 99.17

Names & synonyms

41223-14-72-MethylcyclopentylamineDTXSID00328377RefChem:1063810DTXCID302794842-methylcyclopentan-1-amine2-Methylcyclopentanamine2-Methyl Cyclopentanamine2-methyl-cyclopentylamine(1R,2R)-2-methylcyclopentanamine(1R,2S)-2-methylcyclopentanamine(1S,2R)-2-methylcyclopentanamine

Show more names

Cyclopentanamine, 2-methyl-2-Methylcyclopentane-1-aMine

(1S,2S)-2-methylcyclopentanamineMFCD09035915cis-2-methylcyclopentanamineSCHEMBL43806trans-2-methylcyclopentanamineSCHEMBL1766522SCHEMBL11021512SCHEMBL27903159

Database identifiers

CAS: 41223-14-7
PubChem CID: 409747
DTXSID: DTXSID00328377

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 7
Formal charge: 0
Complexity: 61.2

Physicochemical properties

Melting point: 199 · 199-201 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
Boiling point: 135.71 °C · 135.71°C (estimate)
Density: 0.801 · 0.8010
refractive index: 1.4408 · 1.4408 (estimate)
pka: 10.82 · 10.82±0.40(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319
Precautionary statements: 305 · P305+P351+P338

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H319
Precautionary statements: P305+P351+P338

Chemistry & industry

Applications

Uses2-Methyl CyclopentanaMine is a cyclopentylamine use in the preparation anti-inflammatory and analgesic amides as well as potential human cytomegalovirus primase inhibitors.