2-Amino-6-methyl-4,5,6,7-tetrahydrothieno(2,3-c)pyridine-3-carbonitrile

C₉H₁₁N₃SCAS 37578-06-6193.27 g/mol

Open in Covalent MOL file

Nitrile Primary amine Tertiary amine

Properties

Molecular formula: C₉H₁₁N₃S
Molar mass: 193.27 g/mol
Exact mass: 193.0674 Da
logP: 1.19Crippen estimate
Polar surface area: 53.0 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

37578-06-6

SMILES

CN1CCC2=C(C1)SC(=C2C#N)N

InChIKey

WVPOJZUKIIRHOQ-UHFFFAOYSA-N

InChI

InChI=1S/C9H11N3S/c1-12-3-2-6-7(4-10)9(11)13-8(6)5-12/h2-3,5,11H2,1H3

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Names and synonyms

1 names

2-Amino-6-methyl-4,5,6,7-tetrahydrothieno[2,3-C]pyridine-3-carbonitrile

Work with 2-Amino-6-methyl-4,5,6,7-tetrahydrothieno(2,3-c)pyridine-3-carbonitrile

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

2-Amino-4,5,6,7-tetrahydro-6-(1-methylethyl)thieno[2,3-c]pyridine-3-carbonitrile26830-40-065 % similar 2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile4651-91-656 % similar 2-Amino-5,6-dihydro-4H-cyclopenta[B]thiophene-3-carbonitrile70291-62-256 % similar 2-Amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile42225-04-751 % similar 2,5-Diamino-3,4-dicyanothiophene17989-89-842 % similar Ethyl 5-amino-4-cyano-3-(2-ethoxy-2-oxoethyl)thiophene-2-carboxylate58168-20-033 % similar 2-Amino-4-chloro-5-formyl-3-thiophenecarbonitrile104366-23-631 % similar 5-Amino-3-methyl-4-isothiazolecarbonitrile41808-35-931 % similar

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

Elsewhere

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