4-(1-Piperazinyl)-1H-indole

C₁₂H₁₅N₃CAS 84807-09-0201.27 g/mol

Open in Covalent MOL file

Secondary amine Tertiary amine

Properties

Molecular formula: C₁₂H₁₅N₃
Molar mass: 201.27 g/mol
Exact mass: 201.1266 Da
logP: 1.58Crippen estimate
Polar surface area: 31.1 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

84807-09-0

SMILES

c1cc(N2CCNCC2)c2cc[nH]c2c1

InChIKey

YZKSXUIOKWQABW-UHFFFAOYSA-N

InChI

InChI=1S/C12H15N3/c1-2-11-10(4-5-14-11)12(3-1)15-8-6-13-7-9-15/h1-5,13-14H,6-9H2

Weigh it out

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

Names and synonyms

5 names

1H-Indole, 4-(1-piperazinyl)-
1-(4-Indolyl)piperazine
1-(1H-Indol-4-yl)piperazine
4-(Piperazin-1-yl)-1H-indole
4-(Piperazino)indole

Work with 4-(1-Piperazinyl)-1H-indole

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-(1-Naphthyl)piperazine57536-86-456 % similar 1-(2-Chlorophenyl)piperazine39512-50-049 % similar 2,3-Dichlorophenylpiperazine41202-77-146 % similar N-(2-Chlorophenyl)piperazine monohydrochloride41202-32-845 % similar 1-(2-Methylphenyl)piperazine39512-51-145 % similar 1-(2,3-Dichlorophenyl)piperazine hydrochloride119532-26-243 % similar 1-(2-Cyanophenyl)piperazine111373-03-643 % similar 1-(2-Ethylphenyl)piperazine40224-10-043 % similar

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

Same formula

2-(4-Piperidinyl)-1H-benzimidazole38385-95-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook