1H-Imidazole-1-propanamine

C₆H₁₁N₃CAS 5036-48-6125.17 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₁₁N₃
Molar mass: 125.17 g/mol
Exact mass: 125.0953 Da
Boiling point: 98–100 °C (at 0.2 Torr)
logP: 0.23Crippen estimate
Polar surface area: 43.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Identifiers

CAS number

5036-48-6

SMILES

NCCCn1ccnc1

InChIKey

KDHWOCLBMVSZPG-UHFFFAOYSA-N

InChI

InChI=1S/C6H11N3/c7-2-1-4-9-5-3-8-6-9/h3,5-6H,1-2,4,7H2

Weigh it out

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

Names and synonyms

18 names · show all

Imidazole, 1-(3-aminopropyl)-
1-(3-Aminopropyl)imidazole
3-(1-Imidazolyl)propylamine
N-(3-Aminopropyl)imidazole
3-(1H-Imidazol-1-yl)propylamine
PC CAT API
3-(1H-1-Imidazolyl)-1-propanamine
1-(3-Aminopropyl)-1H-imidazole
3-(Imidazol-1-yl)propylamine
Lupragen API
1-(3′-Aminopropyl)imidazole
N-[3-(1H-Imidazol-1-yl)propyl]amine
3-(1H-Imidazol-1-yl)-1-propylamine
3-Aminopropylimidazole
3-(1H-Imidazol-1-yl)propan-1-amine
3-(1H-Imidazol-1-yl)propanamine
1-(3-Aminopropanyl)imidazole
3-Imidazol-1-ylpropan-1-amine

Work with 1H-Imidazole-1-propanamine

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

Butylimidazole4316-42-159 % similar Imidazole-1-ethanol1615-14-152 % similar 1-Propylimidazole35203-44-252 % similar 1-Ethylimidazole7098-07-945 % similar 1-Allylimidazole31410-01-241 % similar 2-Methyl-1H-imidazole-1-propanamine2258-21-139 % similar 1-Benzylimidazole4238-71-538 % similar 1H-Imidazole-1-acetic acid22884-10-237 % similar

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

Same formula

1,3,5-Trimethyl-1H-pyrazol-4-amine28466-21-9

Elsewhere

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