2,5-dimethylpyrazole-3-carboxamide;hydrochloride

C6H10ClN3O — CID 68886245

IUPAC2,5-dimethylpyrazole-3-carboxamide;hydrochloride
SMILESCc1cc(C(N)=O)n(C)n1.Cl
InChIInChI=1S/C6H9N3O.ClH/c1-4-3-5(6(7)10)9(2)8-4;/h3H,1-2H3,(H2,7,10);1H
InChIKeyCUZFLDJKLWZWMT-UHFFFAOYSA-N
MW175.62 g/mol
LogP0.25
Rot. Bonds1

About 2,5-dimethylpyrazole-3-carboxamide;hydrochloride

2,5-dimethylpyrazole-3-carboxamide;hydrochloride (PubChem CID 68886245) has the molecular formula C6H10ClN3O and a molecular weight of 175.62 g/mol. Its IUPAC name is 2,5-dimethylpyrazole-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name2,5-dimethylpyrazole-3-carboxamide;hydrochloride
PubChem CID68886245
Molecular FormulaC6H10ClN3O
Molecular Weight175.62 g/mol
Exact Mass175.05
IUPAC Name2,5-dimethylpyrazole-3-carboxamide;hydrochloride
SMILESCc1cc(C(N)=O)n(C)n1.Cl
InChIInChI=1S/C6H9N3O.ClH/c1-4-3-5(6(7)10)9(2)8-4;/h3H,1-2H3,(H2,7,10);1H
InChIKeyCUZFLDJKLWZWMT-UHFFFAOYSA-N
XLogP0.25
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.62
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,5-dimethyl-1H-pyrazole-3-carbaldehyde
CID 7017101
N,1,5-trimethyl-1H-pyrazole-3-carboxamide
CID 19279808
Pyrazole-3,5-dicarboxamide, N,N,N',N',1-pentamethyl-
CID 3035271
2,5-Dimethyl-2H-pyrazole-3-carbonyl chloride
CID 2736299
1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride
CID 2737415
1,3-dimethyl-1H-pyrazole-5-carbaldehyde
CID 2776362
1-(1,3-dimethyl-1H-pyrazol-5-yl)ethan-1-one
CID 7017503
4-amino-1,3-dimethyl-1H-pyrazole-5-carboxamide
CID 13822925
1-ethyl-3-methyl-1H-pyrazole-5-carbonyl isothiocyanate
CID 66120676
(1,5-Dimethylpyrazol-3-yl)-[5-(trifluoromethyl)-2,3-dihydro-1,4-diazepin-1-yl]methanone
CID 2738511
1,5-dimethyl-1H-pyrazole-3-carbohydrazide
CID 2743273
1,5-Dimethyl-1H-Pyrazole-3-Carbonyl Chloride
CID 2776364

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrazole-3-carboxamide;hydrochloride?
The IUPAC name of 2,5-dimethylpyrazole-3-carboxamide;hydrochloride (CID 68886245) is 2,5-dimethylpyrazole-3-carboxamide;hydrochloride.
What is the SMILES notation for 2,5-dimethylpyrazole-3-carboxamide;hydrochloride?
The canonical SMILES for 2,5-dimethylpyrazole-3-carboxamide;hydrochloride is Cc1cc(C(N)=O)n(C)n1.Cl.
What is the InChIKey of 2,5-dimethylpyrazole-3-carboxamide;hydrochloride?
The InChIKey is CUZFLDJKLWZWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O.ClH/c1-4-3-5(6(7)10)9(2)8-4;/h3H,1-2H3,(H2,7,10);1H.
What are the key properties of 2,5-dimethylpyrazole-3-carboxamide;hydrochloride?
2,5-dimethylpyrazole-3-carboxamide;hydrochloride has a molecular weight of 175.62 g/mol, XLogP of 0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyrazole-3-carboxamide;hydrochloride is sourced from PubChem (CID 68886245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).