1-Amino-2-methylindoline hydrochloride

C9H13ClN2CAS 102789-79-7184.67 g/mol

Open in Covalent MOL file
NNH2HCl
Primary amineTertiary amine

Properties

Molecular formula
C9H13ClN2
Molar mass
184.67 g/mol
Exact mass
184.0767 Da
logP
1.73Crippen estimate
Polar surface area
29.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
102789-79-7
SMILES
CC1CC2=CC=CC=C2N1N.Cl
InChIKey
RITRKULRSHGFQQ-UHFFFAOYSA-N
InChI
InChI=1S/C9H12N2.ClH/c1-7-6-8-4-2-3-5-9(8)11(7)10;/h2-5,7H,6,10H2,1H3;1H

Weigh it out

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

Work with 1-Amino-2-methylindoline hydrochloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

1-Amino-2-methylindoline31529-46-1Free base

Similar compounds

2-Aminoindan hydrochloride2338-18-340 % similar Promethazine hydrochloride58-33-338 % similar Selegiline hydrochloride14611-52-037 % similar Imipramine hydrochloride113-52-034 % similar Methadone hydrochloride1095-90-533 % similar Desipramine hydrochloride58-28-633 % similar β-Methylbenzeneethanamine hydrochloride20388-87-833 % similar Mianserin hydrochloride21535-47-732 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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