3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide

C5H9N5O — CID 129166500

IUPAC3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide
SMILESCNC(=O)c1c(N)n[nH]c1N
InChIInChI=1S/C5H9N5O/c1-8-5(11)2-3(6)9-10-4(2)7/h1H3,(H,8,11)(H5,6,7,9,10)
InChIKeyOJFKCPJPSULFIJ-UHFFFAOYSA-N
MW155.16 g/mol
LogP-1.07
Rot. Bonds1

About 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide

3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide (PubChem CID 129166500) has the molecular formula C5H9N5O and a molecular weight of 155.16 g/mol. Its IUPAC name is 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide
PubChem CID129166500
Molecular FormulaC5H9N5O
Molecular Weight155.16 g/mol
Exact Mass155.08
IUPAC Name3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide
SMILESCNC(=O)c1c(N)n[nH]c1N
InChIInChI=1S/C5H9N5O/c1-8-5(11)2-3(6)9-10-4(2)7/h1H3,(H,8,11)(H5,6,7,9,10)
InChIKeyOJFKCPJPSULFIJ-UHFFFAOYSA-N
XLogP-1.07
TPSA109.82 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-1.07
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide?
The IUPAC name of 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide (CID 129166500) is 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide is CNC(=O)c1c(N)n[nH]c1N.
What is the InChIKey of 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide?
The InChIKey is OJFKCPJPSULFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N5O/c1-8-5(11)2-3(6)9-10-4(2)7/h1H3,(H,8,11)(H5,6,7,9,10).
What are the key properties of 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide?
3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide has a molecular weight of 155.16 g/mol, XLogP of -1.07, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diamino-N-methyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 129166500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).