N-tert-butylpyrazine-2-carbohydrazide

C9H14N4O — CID 23165237

IUPACN-tert-butylpyrazine-2-carbohydrazide
SMILESCC(C)(C)N(N)C(=O)c1cnccn1
InChIInChI=1S/C9H14N4O/c1-9(2,3)13(10)8(14)7-6-11-4-5-12-7/h4-6H,10H2,1-3H3
InChIKeyGIZMCLPXVCPUNK-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.59
Rot. Bonds1

About N-tert-butylpyrazine-2-carbohydrazide

N-tert-butylpyrazine-2-carbohydrazide (PubChem CID 23165237) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is N-tert-butylpyrazine-2-carbohydrazide.

Molecular Properties

Compound NameN-tert-butylpyrazine-2-carbohydrazide
PubChem CID23165237
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC NameN-tert-butylpyrazine-2-carbohydrazide
SMILESCC(C)(C)N(N)C(=O)c1cnccn1
InChIInChI=1S/C9H14N4O/c1-9(2,3)13(10)8(14)7-6-11-4-5-12-7/h4-6H,10H2,1-3H3
InChIKeyGIZMCLPXVCPUNK-UHFFFAOYSA-N
XLogP0.59
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[tert-butyl(pyrazine-2-carbonyl)amino]propanoic acid
CID 54926288
N-hydroxy-N-methoxypyrazine-2-carboxamide
CID 54209854
N-(2,2-dimethylpropyl)pyrazine-2-carboxamide
CID 21060489
[dithiocarboxy(pyrazine-2-carbonyl)amino]-(pyrazine-2-carbonyl)carbamodithioic acid
CID 87511432
2-amino-1-pyrazin-2-ylpropan-1-one
CID 82594837
N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide
CID 113242357
tetrakis(pyrazine-2-carboxylic acid);zirconium
CID 172643699
pyrazine-2-carbothioic S-acid
CID 87249006
platinum(2+);bis(pyrazine-2-carboxylic acid);dichloride
CID 54591628
N-methyl-N-[2-(methylamino)-2-oxoethyl]pyrazine-2-carboxamide
CID 47112752
2-(diethylamino)-2-methyl-1-pyrazin-2-ylbutan-1-one
CID 79063034
N-deuteriopyrazine-2-carboxamide
CID 175943999

Frequently Asked Questions

What is the IUPAC name of N-tert-butylpyrazine-2-carbohydrazide?
The IUPAC name of N-tert-butylpyrazine-2-carbohydrazide (CID 23165237) is N-tert-butylpyrazine-2-carbohydrazide.
What is the SMILES notation for N-tert-butylpyrazine-2-carbohydrazide?
The canonical SMILES for N-tert-butylpyrazine-2-carbohydrazide is CC(C)(C)N(N)C(=O)c1cnccn1.
What is the InChIKey of N-tert-butylpyrazine-2-carbohydrazide?
The InChIKey is GIZMCLPXVCPUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c1-9(2,3)13(10)8(14)7-6-11-4-5-12-7/h4-6H,10H2,1-3H3.
What are the key properties of N-tert-butylpyrazine-2-carbohydrazide?
N-tert-butylpyrazine-2-carbohydrazide has a molecular weight of 194.24 g/mol, XLogP of 0.59, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butylpyrazine-2-carbohydrazide is sourced from PubChem (CID 23165237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).