2,3-Dihydro-1H-pyrrolo[2,3-B]pyridine

C7H8N2CAS 10592-27-5120.15 g/mol

Open in Covalent MOL file
HNN
Secondary amine

Properties

Molecular formula
C7H8N2
Molar mass
120.15 g/mol
Exact mass
120.0687 Da
logP
1.05Crippen estimate
Polar surface area
24.9 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501

Identifiers

CAS number
10592-27-5
SMILES
C1CNC2=C1C=CC=N2
InChIKey
ZFFYPGZDXUPKNK-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2/c1-2-6-3-5-9-7(6)8-4-1/h1-2,4H,3,5H2,(H,8,9)

Weigh it out

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Names and synonyms

1 names
  • 1H,2H,3H-Pyrrolo(2,3-b)pyridine

Work with 2,3-Dihydro-1H-pyrrolo[2,3-B]pyridine

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

3,4-Dihydro-2H-pyrido(3,2-b)(1,4)oxazine20348-23-648 % similar 5,6,7,8-Tetrahydroquinoline10500-57-947 % similar 6,7-Dihydro-5H-cyclopenta[b]pyridine533-37-947 % similar 5,6,7,8-Tetrahydro-1,7-naphthyridine hydrochloride1338707-67-746 % similar Indoline496-15-145 % similar 2-(Methylamino)-3-pyridinemethanol32399-12-544 % similar 2,3,4,5-Tetrahydro-1H-benzo(d)azepine4424-20-839 % similar 6,7-Dihydro-5H-quinoline-8-one56826-69-838 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Methyl-1H-pyrrole-2-acetonitrile24437-41-0

Elsewhere

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