5-(methylamino)-1H-pyrazole-4-carboxamide

C5H8N4O — CID 58313046

IUPAC5-(methylamino)-1H-pyrazole-4-carboxamide
SMILESCNc1[nH]ncc1C(N)=O
InChIInChI=1S/C5H8N4O/c1-7-5-3(4(6)10)2-8-9-5/h2H,1H3,(H2,6,10)(H2,7,8,9)
InChIKeyVVCMSNQZJQAFND-UHFFFAOYSA-N
MW140.15 g/mol
LogP-0.45
Rot. Bonds2

About 5-(methylamino)-1H-pyrazole-4-carboxamide

5-(methylamino)-1H-pyrazole-4-carboxamide (PubChem CID 58313046) has the molecular formula C5H8N4O and a molecular weight of 140.15 g/mol. Its IUPAC name is 5-(methylamino)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-1H-pyrazole-4-carboxamide
PubChem CID58313046
Molecular FormulaC5H8N4O
Molecular Weight140.15 g/mol
Exact Mass140.07
IUPAC Name5-(methylamino)-1H-pyrazole-4-carboxamide
SMILESCNc1[nH]ncc1C(N)=O
InChIInChI=1S/C5H8N4O/c1-7-5-3(4(6)10)2-8-9-5/h2H,1H3,(H2,6,10)(H2,7,8,9)
InChIKeyVVCMSNQZJQAFND-UHFFFAOYSA-N
XLogP-0.45
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.15
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 5-(methylamino)-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 5-(methylamino)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-(methylamino)-1H-pyrazole-4-carboxamide (CID 58313046) is 5-(methylamino)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-(methylamino)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-(methylamino)-1H-pyrazole-4-carboxamide is CNc1[nH]ncc1C(N)=O.
What is the InChIKey of 5-(methylamino)-1H-pyrazole-4-carboxamide?
The InChIKey is VVCMSNQZJQAFND-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O/c1-7-5-3(4(6)10)2-8-9-5/h2H,1H3,(H2,6,10)(H2,7,8,9).
What are the key properties of 5-(methylamino)-1H-pyrazole-4-carboxamide?
5-(methylamino)-1H-pyrazole-4-carboxamide has a molecular weight of 140.15 g/mol, XLogP of -0.45, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 58313046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).