1-methyl-3-(methylamino)pyrazole-5-carboxamide

C6H10N4O — CID 58757118

IUPAC1-methyl-3-(methylamino)pyrazole-5-carboxamide
SMILESCNc1cc(C(N)=O)n(C)n1
InChIInChI=1S/C6H10N4O/c1-8-5-3-4(6(7)11)10(2)9-5/h3H,1-2H3,(H2,7,11)(H,8,9)
InChIKeyOSZPIEYXLOIXRD-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.44
Rot. Bonds2

About 1-methyl-3-(methylamino)pyrazole-5-carboxamide

1-methyl-3-(methylamino)pyrazole-5-carboxamide (PubChem CID 58757118) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 1-methyl-3-(methylamino)pyrazole-5-carboxamide.

Molecular Properties

Compound Name1-methyl-3-(methylamino)pyrazole-5-carboxamide
PubChem CID58757118
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name1-methyl-3-(methylamino)pyrazole-5-carboxamide
SMILESCNc1cc(C(N)=O)n(C)n1
InChIInChI=1S/C6H10N4O/c1-8-5-3-4(6(7)11)10(2)9-5/h3H,1-2H3,(H2,7,11)(H,8,9)
InChIKeyOSZPIEYXLOIXRD-UHFFFAOYSA-N
XLogP-0.44
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(methylamino)pyrazole-5-carboxamide?
The IUPAC name of 1-methyl-3-(methylamino)pyrazole-5-carboxamide (CID 58757118) is 1-methyl-3-(methylamino)pyrazole-5-carboxamide.
What is the SMILES notation for 1-methyl-3-(methylamino)pyrazole-5-carboxamide?
The canonical SMILES for 1-methyl-3-(methylamino)pyrazole-5-carboxamide is CNc1cc(C(N)=O)n(C)n1.
What is the InChIKey of 1-methyl-3-(methylamino)pyrazole-5-carboxamide?
The InChIKey is OSZPIEYXLOIXRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-8-5-3-4(6(7)11)10(2)9-5/h3H,1-2H3,(H2,7,11)(H,8,9).
What are the key properties of 1-methyl-3-(methylamino)pyrazole-5-carboxamide?
1-methyl-3-(methylamino)pyrazole-5-carboxamide has a molecular weight of 154.17 g/mol, XLogP of -0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(methylamino)pyrazole-5-carboxamide is sourced from PubChem (CID 58757118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).