chempirical

1-Methylhomopiperazine

C6H14N2CAS 4318-37-0114.19 g/mol

Open in Covalent MOL file
NNH
Secondary amineTertiary amine

Properties

Molecular formula
C6H14N2
Molar mass
114.19 g/mol
Exact mass
114.1157 Da
logP
-0.09Crippen estimate
Polar surface area
15.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
4318-37-0
SMILES
CN1CCCNCC1
InChIKey
FXHRAKUEZPSMLJ-UHFFFAOYSA-N
InChI
InChI=1S/C6H14N2/c1-8-5-2-3-7-4-6-8/h7H,2-6H2,1H3

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Names and synonyms

1 names
  • N-Methylhomopiperazine

Work with 1-Methylhomopiperazine

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

Methylpiperazine109-01-378 % similar 1-Methylpiperazine dihydrochloride34352-59-567 % similar 3,3′-Iminobis(N,N-dimethylpropylamine)6711-48-455 % similar 1-Methylpyrrolidine120-94-553 % similar 1-(1-Methyl-4-piperidinyl)piperazine23995-88-250 % similar 1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane41203-22-950 % similar N-Methylpiperidine626-67-550 % similar N1,N2-Dimethyl-N1-[2-(methylamino)ethyl]-1,2-ethanediamine105-84-048 % similar

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

Same formula

2,5-Dimethylpiperazine106-55-8 1,4-Dimethylpiperazine106-58-1 2,6-Dimethylpiperazine108-49-6 trans-1,2-Diaminocyclohexane1121-22-8 1-Methyl-3-pyrrolidinemethanamine13005-11-3 (3S)-(-)-3-(Dimethylamino)pyrrolidine132883-44-4 (3R)-(+)-3-(Dimethylamino)pyrrolidine132958-72-6 2-Ethylpiperazine13961-37-0

Elsewhere

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