6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide

C13H17N5OS — CID 80527740

IUPAC6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide
SMILESCC(C)(CNC(=O)c1ccc(NN)nn1)c1cccs1
InChIInChI=1S/C13H17N5OS/c1-13(2,10-4-3-7-20-10)8-15-12(19)9-5-6-11(16-14)18-17-9/h3-7H,8,14H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyFOEBKENUXAFLOL-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.53
Rot. Bonds5

About 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide

6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide (PubChem CID 80527740) has the molecular formula C13H17N5OS and a molecular weight of 291.38 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide
PubChem CID80527740
Molecular FormulaC13H17N5OS
Molecular Weight291.38 g/mol
Exact Mass291.12
IUPAC Name6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide
SMILESCC(C)(CNC(=O)c1ccc(NN)nn1)c1cccs1
InChIInChI=1S/C13H17N5OS/c1-13(2,10-4-3-7-20-10)8-15-12(19)9-5-6-11(16-14)18-17-9/h3-7H,8,14H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyFOEBKENUXAFLOL-UHFFFAOYSA-N
XLogP1.53
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

6-[(2-methyl-2-thiophen-2-ylpropyl)carbamoyl]pyridine-3-carboxylic acid
CID 80524375
3-amino-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-2-carboxamide
CID 104742615
6-fluoro-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-2-carboxamide
CID 115498038
5-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-thiadiazole-2-carboxamide
CID 80624243
4-[(2-methyl-2-thiophen-2-ylpropyl)carbamoyl]benzoic acid
CID 80524374
4-amino-N-(2-methyl-2-thiophen-2-ylpropyl)-1,2,5-oxadiazole-3-carboxamide
CID 80527456
5-amino-2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-carboxamide
CID 80526889
5-bromo-N-(2-methyl-2-thiophen-2-ylpropyl)furan-2-carboxamide
CID 78962266
6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-sulfonamide
CID 80522758
4-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-carboxamide
CID 81245260
4-amino-2-fluoro-N-(2-methyl-2-thiophen-2-ylpropyl)benzamide
CID 80526929
6-hydrazinyl-N-(3-methylbutyl)pyridazine-3-carboxamide
CID 62237645

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide (CID 80527740) is 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide is CC(C)(CNC(=O)c1ccc(NN)nn1)c1cccs1.
What is the InChIKey of 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide?
The InChIKey is FOEBKENUXAFLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5OS/c1-13(2,10-4-3-7-20-10)8-15-12(19)9-5-6-11(16-14)18-17-9/h3-7H,8,14H2,1-2H3,(H,15,19)(H,16,18).
What are the key properties of 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide?
6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 1.53, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridazine-3-carboxamide is sourced from PubChem (CID 80527740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).