4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide

C9H10N6O2 — CID 122692069

IUPAC4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide
SMILESNNC(=O)c1cc2c(N)c(C(N)=O)cnn2c1
InChIInChI=1S/C9H10N6O2/c10-7-5(8(11)16)2-13-15-3-4(1-6(7)15)9(17)14-12/h1-3H,10,12H2,(H2,11,16)(H,14,17)
InChIKeyPYEIKGHZZFCCTM-UHFFFAOYSA-N
MW234.22 g/mol
LogP-1.38
Rot. Bonds2

About 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide

4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide (PubChem CID 122692069) has the molecular formula C9H10N6O2 and a molecular weight of 234.22 g/mol. Its IUPAC name is 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide
PubChem CID122692069
Molecular FormulaC9H10N6O2
Molecular Weight234.22 g/mol
Exact Mass234.09
IUPAC Name4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide
SMILESNNC(=O)c1cc2c(N)c(C(N)=O)cnn2c1
InChIInChI=1S/C9H10N6O2/c10-7-5(8(11)16)2-13-15-3-4(1-6(7)15)9(17)14-12/h1-3H,10,12H2,(H2,11,16)(H,14,17)
InChIKeyPYEIKGHZZFCCTM-UHFFFAOYSA-N
XLogP-1.38
TPSA141.53 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 5-1.38
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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

4-amino-6-(5-fluoro-3-pyridinyl)pyrrolo[1,2-b]pyridazine-3-carboxamide
CID 122500204
4-amino-6-(3-methyl-4-pyridinyl)pyrrolo[1,2-b]pyridazine-3-carboxamide
CID 123509575
6-amino-4-(cyclopentylamino)pyrrolo[1,2-b]pyridazine-3-carboxamide
CID 50914624
5-(1-methylpyrazol-4-yl)pyridine-3-carbohydrazide
CID 175442259
ethyl 3-carbamoyl-4-[[(1R,3R)-2,2,3-trimethylcyclopentyl]amino]pyrrolo[1,2-b]pyridazine-6-carboxylate
CID 122500178
6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 141364751
[1,2,4]triazolo[1,5-a]pyridine-6-carbohydrazide
CID 169101289
2-aminopyrimidine-5-carbohydrazide
CID 67479217
6-amino-4-[[(1S,2R)-2-methylcyclohexyl]amino]pyrrolo[1,2-b]pyridazine-3-carboxamide
CID 50914486
4-methyl-6-[5-(methylamino)-1,3,4-oxadiazol-2-yl]pyrrolo[1,2-b]pyridazine-3-carboxamide
CID 130183717
4-anilino-6-nitrosopyrrolo[1,2-b]pyridazine-3-carboxamide
CID 88535151
(pyrazolo[1,5-a]pyrazine-3-carbonylamino)thiourea
CID 103123485

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide?
The IUPAC name of 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide (CID 122692069) is 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide.
What is the SMILES notation for 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide?
The canonical SMILES for 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide is NNC(=O)c1cc2c(N)c(C(N)=O)cnn2c1.
What is the InChIKey of 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide?
The InChIKey is PYEIKGHZZFCCTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6O2/c10-7-5(8(11)16)2-13-15-3-4(1-6(7)15)9(17)14-12/h1-3H,10,12H2,(H2,11,16)(H,14,17).
What are the key properties of 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide?
4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide has a molecular weight of 234.22 g/mol, XLogP of -1.38, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(hydrazinecarbonyl)pyrrolo[1,2-b]pyridazine-3-carboxamide is sourced from PubChem (CID 122692069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).