chempirical

1,3-Dimethyl-1H-pyrazole-5-carboxamide

C6H9N3OCAS 136678-93-8139.16 g/mol

Open in Covalent MOL file
NNONH2
Amide

Properties

Molecular formula
C6H9N3O
Molar mass
139.16 g/mol
Exact mass
139.0746 Da
logP
-0.17Crippen estimate
Polar surface area
60.9 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
136678-93-8
SMILES
CC1=NN(C(=C1)C(=O)N)C
InChIKey
RKOPPJWNONMZGZ-UHFFFAOYSA-N
InChI
InChI=1S/C6H9N3O/c1-4-3-5(6(7)10)9(2)8-4/h3H,1-2H3,(H2,7,10)

Weigh it out

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

Work with 1,3-Dimethyl-1H-pyrazole-5-carboxamide

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

1,3-Dimethyl-1H-pyrazol-5-amine3524-32-147 % similar 1,3,5-Trimethylpyrazole1072-91-945 % similar 5-Chloro-1,3-dimethyl-1H-pyrazole54454-10-343 % similar 5-Bromo-1,3-dimethyl-1H-pyrazole5744-70-743 % similar 5-(Chloromethyl)-1,3-dimethyl-1H-pyrazole852227-86-239 % similar 4-Amino-1-methyl-3-propyl-1H-pyrazole-5-carboxamide139756-02-835 % similar 3,4-Dimethylbenzamide5580-33-634 % similar 1-Methyl-4-nitro-3-propyl-1H-pyrazole-5-carboxamide139756-01-733 % similar

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

Same formula

2,3-Diamino-6-methoxypyridine28020-38-4 2-Amino-5,6-dimethyl-4(3H)-pyrimidinone3977-23-9 Toxopyrimidine73-67-6 3,5-Dimethyl-1H-pyrazole-1-carboxamide934-48-5

Elsewhere

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