chempirical

Indole-3-propanol

C11H13NOCAS 3569-21-9175.23 g/mol

Open in Covalent MOL file
HONH
Alcohol

Properties

Molecular formula
C11H13NO
Molar mass
175.23 g/mol
Exact mass
175.0997 Da
Melting point
0 °C
logP
2.09Crippen estimate
Polar surface area
36.0 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
3

Identifiers

CAS number
3569-21-9
SMILES
OCCCc1c[nH]c2ccccc12
InChIKey
LYPSVQXMCZIRGP-UHFFFAOYSA-N
InChI
InChI=1S/C11H13NO/c13-7-3-4-9-8-12-11-6-2-1-5-10(9)11/h1-2,5-6,8,12-13H,3-4,7H2

Weigh it out

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

Names and synonyms

7 names
  • 1H-Indole-3-propanol
  • Homotryptophol
  • 3-(1H-Indol-3-yl)-1-propanol
  • 3-(3-Hydroxypropyl)indole
  • 3-(3-Hydroxypropyl)-1H-indole
  • 3-(3-Indolyl)-1-propanol
  • 3-(1H-Indol-3-yl)propanol

Work with Indole-3-propanol

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

Tryptophol526-55-679 % similar Indole-3-carbinol700-06-165 % similar 3,3'-Diindolylmethane1968-05-460 % similar Indole-3-butyric acid133-32-458 % similar 3-(2-Bromoethyl)indole3389-21-758 % similar Tryptamine61-54-158 % similar Methyltryptamine61-49-457 % similar Tryptamine hydrochloride343-94-253 % similar

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

Same formula

4-(1-Pyrrolidinyl)benzaldehyde51980-54-2 4-Butoxybenzonitrile5203-14-5 1-Benzyl-2-pyrrolidinone5291-77-0 4-(Dimethylamino)cinnamaldehyde6203-18-5 4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol69088-96-6 1-(Phenylmethyl)-3-pyrrolidinone775-16-6

Elsewhere

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