5-amino-1,3-dimethylpyrazole-4-carboxamide

C6H10N4O — CID 10654442

IUPAC5-amino-1,3-dimethylpyrazole-4-carboxamide
SMILESCc1nn(C)c(N)c1C(N)=O
InChIInChI=1S/C6H10N4O/c1-3-4(6(8)11)5(7)10(2)9-3/h7H2,1-2H3,(H2,8,11)
InChIKeyCCXYHAGBWDDQON-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.59
Rot. Bonds1

About 5-amino-1,3-dimethylpyrazole-4-carboxamide

5-amino-1,3-dimethylpyrazole-4-carboxamide (PubChem CID 10654442) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 5-amino-1,3-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1,3-dimethylpyrazole-4-carboxamide
PubChem CID10654442
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name5-amino-1,3-dimethylpyrazole-4-carboxamide
SMILESCc1nn(C)c(N)c1C(N)=O
InChIInChI=1S/C6H10N4O/c1-3-4(6(8)11)5(7)10(2)9-3/h7H2,1-2H3,(H2,8,11)
InChIKeyCCXYHAGBWDDQON-UHFFFAOYSA-N
XLogP-0.59
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1,3-dimethylpyrazole-4-carboxamide?
The IUPAC name of 5-amino-1,3-dimethylpyrazole-4-carboxamide (CID 10654442) is 5-amino-1,3-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1,3-dimethylpyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1,3-dimethylpyrazole-4-carboxamide is Cc1nn(C)c(N)c1C(N)=O.
What is the InChIKey of 5-amino-1,3-dimethylpyrazole-4-carboxamide?
The InChIKey is CCXYHAGBWDDQON-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-3-4(6(8)11)5(7)10(2)9-3/h7H2,1-2H3,(H2,8,11).
What are the key properties of 5-amino-1,3-dimethylpyrazole-4-carboxamide?
5-amino-1,3-dimethylpyrazole-4-carboxamide has a molecular weight of 154.17 g/mol, XLogP of -0.59, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1,3-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 10654442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).