4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride

C6H11ClN4O — CID 44630897

IUPAC4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride
SMILESCNC(=O)c1nn(C)cc1N.Cl
InChIInChI=1S/C6H10N4O.ClH/c1-8-6(11)5-4(7)3-10(2)9-5;/h3H,7H2,1-2H3,(H,8,11);1H
InChIKeyZCIAEJYACXJCRN-UHFFFAOYSA-N
MW190.63 g/mol
LogP-0.22
Rot. Bonds1

About 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride

4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride (PubChem CID 44630897) has the molecular formula C6H11ClN4O and a molecular weight of 190.63 g/mol. Its IUPAC name is 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride
PubChem CID44630897
Molecular FormulaC6H11ClN4O
Molecular Weight190.63 g/mol
Exact Mass190.06
IUPAC Name4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride
SMILESCNC(=O)c1nn(C)cc1N.Cl
InChIInChI=1S/C6H10N4O.ClH/c1-8-6(11)5-4(7)3-10(2)9-5;/h3H,7H2,1-2H3,(H,8,11);1H
InChIKeyZCIAEJYACXJCRN-UHFFFAOYSA-N
XLogP-0.22
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.63
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride?
The IUPAC name of 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride (CID 44630897) is 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride.
What is the SMILES notation for 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride?
The canonical SMILES for 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride is CNC(=O)c1nn(C)cc1N.Cl.
What is the InChIKey of 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride?
The InChIKey is ZCIAEJYACXJCRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O.ClH/c1-8-6(11)5-4(7)3-10(2)9-5;/h3H,7H2,1-2H3,(H,8,11);1H.
What are the key properties of 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride?
4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride has a molecular weight of 190.63 g/mol, XLogP of -0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,1-dimethylpyrazole-3-carboxamide;hydrochloride is sourced from PubChem (CID 44630897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).