chempirical

1H-Pyrazolo[4,3-C]pyridine-3-carboxamide, 4,5,6,7-tetrahydro-N-(2-hydroxyethyl)-N-methyl-, hydrochloride (1:1)

C10H17ClN4O2CAS 1219976-29-0260.72 g/mol

Open in Covalent MOL file
NHOONHNNHHCl
AlcoholAmideSecondary amine

Properties

Molecular formula
C10H17ClN4O2
Molar mass
260.72 g/mol
Exact mass
260.1040 Da
logP
-0.46Crippen estimate
Polar surface area
81.3 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
3

Identifiers

CAS number
1219976-29-0
SMILES
CN(CCO)C(=O)c1n[nH]c2c1CNCC2.Cl
InChIKey
RASRXDGJZGGEIF-UHFFFAOYSA-N
InChI
InChI=1S/C10H16N4O2.ClH/c1-14(4-5-15)10(16)9-7-6-11-3-2-8(7)12-13-9;/h11,15H,2-6H2,1H3,(H,12,13);1H

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Work with 1H-Pyrazolo[4,3-C]pyridine-3-carboxamide, 4,5,6,7-tetrahydro-N-(2-hydroxyethyl)-N-methyl-, hydrochloride (1:1)

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

1H-Pyrazolo[4,3-C]pyridine-3-carboxamide, N-butyl-4,5,6,7-tetrahydro-N-methyl-, hydrochloride (1:1)1220017-77-575 % similar N,N-Dimethyl-4,5,6,7-tetrahydro-1H-pyrazolo-[4,3-C]pyridine-3-carboxamide hydrochloride1211512-45-669 % similar Methanone, 1-pyrrolidinyl(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-C]pyridin-3-yl)-, hydrochloride (1:1)1219976-21-265 % similar (4-Methyl-1-piperidinyl)(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-C]pyridin-3-yl)methanone hcl1220029-24-264 % similar 1H-Pyrazolo[4,3-C]pyridine-3-carboxamide, N,N-diethyl-4,5,6,7-tetrahydro-, hydrochloride (1:1)1220017-83-363 % similar 1-Piperidinyl(4,5,6,7-tetrahydro-1H-pyrazolo-[4,3-C]pyridin-3-yl)methanone hydrochloride1220039-26-863 % similar 4-Morpholinyl(4,5,6,7-tetrahydro-1H-pyrazolo-[4,3-C]pyridin-3-yl)methanone hydrochloride1220027-05-361 % similar Methanone, (3-hydroxy-1-pyrrolidinyl)(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-C]pyridin-3-yl)-, hydrochloride (1:1)1219976-33-659 % similar

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

Elsewhere

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