chempirical

1-Amino-1-methylcyclohexane

C7H15NCAS 6526-78-9113.20 g/mol

Open in Covalent MOL file
H2N
Primary amine

Properties

Molecular formula
C7H15N
Molar mass
113.20 g/mol
Exact mass
113.1204 Da
logP
1.67Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
6526-78-9
SMILES
CC1(CCCCC1)N
InChIKey
YDBHSDRXUCPTQQ-UHFFFAOYSA-N
InChI
InChI=1S/C7H15N/c1-7(8)5-3-2-4-6-7/h2-6,8H2,1H3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • 1-Methylcyclohexan-1-amine
  • 1-Methylcyclohexanamine
  • (1-Methylcyclohexyl)amine
  • Amino-methylcyclohexane
  • 1-Methylcyclohexaneamine
  • 1,4-Methylcyclohexylamine
  • 1-Methyl-1-cyclohexylamine
  • (1-Methyl-cyclohexyl)-amine
  • Cyclohexane, 1-amino-1-methyl-

Work with 1-Amino-1-methylcyclohexane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Amino-1-methylcyclobutane hydrochloride174886-05-668 % similar 1,8-Diamino-P-menthane80-52-444 % similar 2-Amino-2-methyl-1,3-propanediol115-69-543 % similar 1,1-Dimethylcyclohexane590-66-942 % similar 1,1-Bis(tert-butylperoxy)cyclohexane3006-86-832 % similar 1-Methylcyclopentanol1462-03-932 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methylcyclohexylamine100-60-7 Azocane1121-92-2 3,3-Dimethylpiperidine1193-12-0 2-Ethylpiperidine1484-80-6 trans-4-Methylcyclohexylamine2523-55-9 (Cyclopropylmethyl)propylamine26389-60-6 Cyclohexanemethanamine3218-02-8 3,5-Dimethylpiperidine35794-11-7

Elsewhere

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