N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide

C9H11N7O — CID 43833181

IUPACN'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide
SMILESCNNC(=O)Cc1nc(-c2cnccn2)n[nH]1
InChIInChI=1S/C9H11N7O/c1-10-15-8(17)4-7-13-9(16-14-7)6-5-11-2-3-12-6/h2-3,5,10H,4H2,1H3,(H,15,17)(H,13,14,16)
InChIKeyGJKWDWHXTGGKQC-UHFFFAOYSA-N
MW233.23 g/mol
LogP-0.95
Rot. Bonds4

About N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide

N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide (PubChem CID 43833181) has the molecular formula C9H11N7O and a molecular weight of 233.23 g/mol. Its IUPAC name is N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide.

Molecular Properties

Compound NameN'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide
PubChem CID43833181
Molecular FormulaC9H11N7O
Molecular Weight233.23 g/mol
Exact Mass233.10
IUPAC NameN'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide
SMILESCNNC(=O)Cc1nc(-c2cnccn2)n[nH]1
InChIInChI=1S/C9H11N7O/c1-10-15-8(17)4-7-13-9(16-14-7)6-5-11-2-3-12-6/h2-3,5,10H,4H2,1H3,(H,15,17)(H,13,14,16)
InChIKeyGJKWDWHXTGGKQC-UHFFFAOYSA-N
XLogP-0.95
TPSA108.48 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 5-0.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide?
The IUPAC name of N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide (CID 43833181) is N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide.
What is the SMILES notation for N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide?
The canonical SMILES for N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide is CNNC(=O)Cc1nc(-c2cnccn2)n[nH]1.
What is the InChIKey of N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide?
The InChIKey is GJKWDWHXTGGKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N7O/c1-10-15-8(17)4-7-13-9(16-14-7)6-5-11-2-3-12-6/h2-3,5,10H,4H2,1H3,(H,15,17)(H,13,14,16).
What are the key properties of N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide?
N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide has a molecular weight of 233.23 g/mol, XLogP of -0.95, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-2-(3-pyrazin-2-yl-1H-1,2,4-triazol-5-yl)acetohydrazide is sourced from PubChem (CID 43833181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).