3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide

C6H9N7O — CID 137263611

IUPAC3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide
SMILESNN/C=N/c1nccnc1/C(N)=N/O
InChIInChI=1S/C6H9N7O/c7-5(13-14)4-6(11-3-12-8)10-2-1-9-4/h1-3,14H,8H2,(H2,7,13)(H,10,11,12)
InChIKeyDSCRPKCBFILZFB-UHFFFAOYSA-N
MW195.19 g/mol
LogP-1.31
Rot. Bonds3

About 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide

3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide (PubChem CID 137263611) has the molecular formula C6H9N7O and a molecular weight of 195.19 g/mol. Its IUPAC name is 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide.

Molecular Properties

Compound Name3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide
PubChem CID137263611
Molecular FormulaC6H9N7O
Molecular Weight195.19 g/mol
Exact Mass195.09
IUPAC Name3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide
SMILESNN/C=N/c1nccnc1/C(N)=N/O
InChIInChI=1S/C6H9N7O/c7-5(13-14)4-6(11-3-12-8)10-2-1-9-4/h1-3,14H,8H2,(H2,7,13)(H,10,11,12)
InChIKeyDSCRPKCBFILZFB-UHFFFAOYSA-N
XLogP-1.31
TPSA134.80 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 5-1.31
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide?
The IUPAC name of 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide (CID 137263611) is 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide.
What is the SMILES notation for 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide?
The canonical SMILES for 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide is NN/C=N/c1nccnc1/C(N)=N/O.
What is the InChIKey of 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide?
The InChIKey is DSCRPKCBFILZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N7O/c7-5(13-14)4-6(11-3-12-8)10-2-1-9-4/h1-3,14H,8H2,(H2,7,13)(H,10,11,12).
What are the key properties of 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide?
3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide has a molecular weight of 195.19 g/mol, XLogP of -1.31, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydrazinylmethylideneamino)-N'-hydroxypyrazine-2-carboximidamide is sourced from PubChem (CID 137263611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).