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N-ethyl-2-methyl-1-(1-methylethyl)cyclopentanecarboxamide

HCID 91872
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Basic information

CAS
56471-14-8
Standard SMILES
CCNC(=O)C1(C(C)C)CCCC1C
InChIKey
XDJYXLAMICXHRP-UHFFFAOYSA-N
Molecular formula
C12H23NO
Average molar mass
197.32 g/mol
Monoisotopic mass
197.17796436

Names & identifiers

Preferred name
N-ethyl-2-methyl-1-(1-methylethyl)cyclopentanecarboxamide
IUPAC
N-ethyl-2-methyl-1-propan-2-ylcyclopentane-1-carboxamide
English name
N-ethyl-2-methyl-1-(1-methylethyl)cyclopentanecarboxamide
Molecular formula
C12H23NO
Molecular weight
197.32

Names & synonyms

56471-14-8EINECS 260-197-6N-Ethyl-2-methyl-1-(1-methylethyl)cyclopentanecarboxamideRefChem:163306260-197-6SCHEMBL11290571DTXSID70971879XDJYXLAMICXHRP-UHFFFAOYSA-NDB-321130NS00054205N-Ethyl-2-methyl-1-(propan-2-yl)cyclopentane-1-carboximidic acidN-Ethyl-2-methyl-1-isopropylcyclopentanecarboxamide
Show more names
Cyclopentanecarboxamide, N-ethyl-2-methyl-1-(1-methylethyl)-

Database identifiers

CAS
56471-14-8
PubChem CID
91872
DTXSID
DTXSID70971879
EC Number
260-197-6
Nikkaji
J296.678F

Properties

Computed structural propertiesFilling in

XLogP
3
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
212

Physicochemical properties

Boiling point
318 · 318.0±9.0 °C(Predicted)
Density
0.914 · 0.914±0.06 g/cm3(Predicted)
pka
16.45 · 16.45±0.40(Predicted)

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