1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide

C10H13N7O — CID 80904045

IUPAC1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide
SMILESCN(C)C(=O)c1ccn(-c2cncc(NN)n2)n1
InChIInChI=1S/C10H13N7O/c1-16(2)10(18)7-3-4-17(15-7)9-6-12-5-8(13-9)14-11/h3-6H,11H2,1-2H3,(H,13,14)
InChIKeyOTICUDBRAAYOQQ-UHFFFAOYSA-N
MW247.26 g/mol
LogP-0.35
Rot. Bonds3

About 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide

1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide (PubChem CID 80904045) has the molecular formula C10H13N7O and a molecular weight of 247.26 g/mol. Its IUPAC name is 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide
PubChem CID80904045
Molecular FormulaC10H13N7O
Molecular Weight247.26 g/mol
Exact Mass247.12
IUPAC Name1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide
SMILESCN(C)C(=O)c1ccn(-c2cncc(NN)n2)n1
InChIInChI=1S/C10H13N7O/c1-16(2)10(18)7-3-4-17(15-7)9-6-12-5-8(13-9)14-11/h3-6H,11H2,1-2H3,(H,13,14)
InChIKeyOTICUDBRAAYOQQ-UHFFFAOYSA-N
XLogP-0.35
TPSA101.96 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

1-(5,6-diamino-2-pyridinyl)-N,N-dimethylpyrazole-3-carboxamide
CID 79827052
6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid
CID 64781715
1-(5-bromo-4-methyl-2-pyridinyl)-N,N-dimethylpyrazole-3-carboxamide
CID 114870573
1-(6-methoxycarbonylpyrazin-2-yl)pyrazole-3-carboxylic acid
CID 66457610
1-(5-amino-1,3-thiazol-2-yl)-N,N-dimethylpyrazole-3-carboxamide
CID 102769211
1-[6-chloro-4-(trifluoromethyl)-2-pyridinyl]-N,N-dimethylpyrazole-3-carboxamide
CID 102716274
1-[4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl]-N,N-dimethylpyrazole-3-carboxamide
CID 64780614
N,N-dimethyl-1-[5-(propylaminomethyl)-2-pyridinyl]pyrazole-3-carboxamide
CID 80636555
1-[6-chloro-2-(trifluoromethyl)pyrimidin-4-yl]-N,N-dimethylpyrazole-3-carboxamide
CID 106768586
1-(4-acetylphenyl)-N,N-dimethylpyrazole-3-carboxamide
CID 64781535
1-[4-[(1S)-1-aminoethyl]phenyl]-N,N-dimethylpyrazole-3-carboxamide
CID 64780391
6-hydrazinyl-N,N-dimethylpyridazine-3-carboxamide
CID 62236767

Frequently Asked Questions

What is the IUPAC name of 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide?
The IUPAC name of 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide (CID 80904045) is 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide.
What is the SMILES notation for 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide?
The canonical SMILES for 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide is CN(C)C(=O)c1ccn(-c2cncc(NN)n2)n1.
What is the InChIKey of 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide?
The InChIKey is OTICUDBRAAYOQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N7O/c1-16(2)10(18)7-3-4-17(15-7)9-6-12-5-8(13-9)14-11/h3-6H,11H2,1-2H3,(H,13,14).
What are the key properties of 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide?
1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide has a molecular weight of 247.26 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-hydrazinylpyrazin-2-yl)-N,N-dimethylpyrazole-3-carboxamide is sourced from PubChem (CID 80904045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).