3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide

C8H10N6OS — CID 91759735

IUPAC3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide
SMILESCc1nnsc1CNC(=O)c1cc(N)n[nH]1
InChIInChI=1S/C8H10N6OS/c1-4-6(16-14-11-4)3-10-8(15)5-2-7(9)13-12-5/h2H,3H2,1H3,(H,10,15)(H3,9,12,13)
InChIKeyAGPHVDNQEUOXLI-UHFFFAOYSA-N
MW238.28 g/mol
LogP0.08
Rot. Bonds3

About 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide

3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide (PubChem CID 91759735) has the molecular formula C8H10N6OS and a molecular weight of 238.28 g/mol. Its IUPAC name is 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide
PubChem CID91759735
Molecular FormulaC8H10N6OS
Molecular Weight238.28 g/mol
Exact Mass238.06
IUPAC Name3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide
SMILESCc1nnsc1CNC(=O)c1cc(N)n[nH]1
InChIInChI=1S/C8H10N6OS/c1-4-6(16-14-11-4)3-10-8(15)5-2-7(9)13-12-5/h2H,3H2,1H3,(H,10,15)(H3,9,12,13)
InChIKeyAGPHVDNQEUOXLI-UHFFFAOYSA-N
XLogP0.08
TPSA109.58 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 50.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-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-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide (CID 91759735) is 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide is Cc1nnsc1CNC(=O)c1cc(N)n[nH]1.
What is the InChIKey of 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide?
The InChIKey is AGPHVDNQEUOXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6OS/c1-4-6(16-14-11-4)3-10-8(15)5-2-7(9)13-12-5/h2H,3H2,1H3,(H,10,15)(H3,9,12,13).
What are the key properties of 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide?
3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide has a molecular weight of 238.28 g/mol, XLogP of 0.08, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(4-methylthiadiazol-5-yl)methyl]-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 91759735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).