chempirical

2-Propylimidazole

C6H10N2CAS 50995-95-4110.16 g/mol

Open in Covalent MOL file
NHN

Properties

Molecular formula
C6H10N2
Molar mass
110.16 g/mol
Exact mass
110.0844 Da
Melting point
35 °C
logP
1.36Crippen estimate
Polar surface area
28.7 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
50995-95-4
SMILES
CCCc1ncc[nH]1
InChIKey
MKBBSFGKFMQPPC-UHFFFAOYSA-N
InChI
InChI=1S/C6H10N2/c1-2-3-6-7-4-5-8-6/h4-5H,2-3H2,1H3,(H,7,8)

Weigh it out

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

Names and synonyms

6 names
  • 1H-Imidazole, 2-propyl-
  • Imidazole, 2-propyl-
  • 2-Propyl-1H-imidazole
  • 2-n-Propylimidazole
  • Actiron NXJ 60
  • NXJ 60

Work with 2-Propylimidazole

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

2-Undecylimidazole16731-68-371 % similar 2-Heptadecylimidazole23328-87-271 % similar 2-Ethylimidazole1072-62-462 % similar 1H-Imidazole-2-methanol3724-26-350 % similar 1H-Imidazole-2-methanamine53332-80-250 % similar 2-Methylimidazole693-98-139 % similar 2,2′-Biimidazole492-98-838 % similar 4-Propylpyridine1122-81-238 % similar

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

Same formula

1,3,5-Trimethylpyrazole1072-91-9 1-Isopropyl-1H-pyrazole18952-87-9 1-Pyrrolidineacetonitrile29134-29-0 1-Propylimidazole35203-44-2 2-Isopropylimidazole36947-68-9 1-(1-Methylethyl)-1H-imidazole4532-96-1 2-Ethyl-4-methylimidazole931-36-2

Elsewhere

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