N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide

C12H19N5O2 — CID 63832738

IUPACN-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCCOC2CCCC2)nn1
InChIInChI=1S/C12H19N5O2/c13-15-11-6-5-10(16-17-11)12(18)14-7-8-19-9-3-1-2-4-9/h5-6,9H,1-4,7-8,13H2,(H,14,18)(H,15,17)
InChIKeyPGQFHOMZBQIQSX-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.45
Rot. Bonds6

About N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide

N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide (PubChem CID 63832738) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide
PubChem CID63832738
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC NameN-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide
SMILESNNc1ccc(C(=O)NCCOC2CCCC2)nn1
InChIInChI=1S/C12H19N5O2/c13-15-11-6-5-10(16-17-11)12(18)14-7-8-19-9-3-1-2-4-9/h5-6,9H,1-4,7-8,13H2,(H,14,18)(H,15,17)
InChIKeyPGQFHOMZBQIQSX-UHFFFAOYSA-N
XLogP0.45
TPSA102.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-(2-cyclopentyloxyethyl)-6-(propylamino)pyridazine-3-carboxamide
CID 63832896
N-(2-cyclohexylethyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62235799
6-hydrazinyl-N-[(2-methylcyclohexyl)methyl]pyridazine-3-carboxamide
CID 55052556
6-hydrazinyl-N-(3-methylbutyl)pyridazine-3-carboxamide
CID 62237645
(6-hydrazinylpyridazin-3-yl)-[4-(2-hydroxyethoxy)piperidin-1-yl]methanone
CID 82691902
6-hydrazinyl-N-(thian-2-ylmethyl)pyridazine-3-carboxamide
CID 80612211
6-hydrazinyl-N-(2-piperidin-1-ylethyl)pyridazine-3-carboxamide
CID 62249790
2-amino-N-(2-cyclopentyloxyethyl)-1,3-thiazole-4-carboxamide
CID 63826341
N-(2-cyclohexyloxyethyl)-3-fluoro-2-hydrazinylbenzamide
CID 63833449
3-amino-2-chloro-N-(2-cyclopentyloxyethyl)benzamide
CID 112575924
6-(cycloheptylamino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
CID 109124661
6-(cyclohexylamino)-N-(3-methylbutyl)pyridazine-3-carboxamide
CID 109112877

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide?
The IUPAC name of N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide (CID 63832738) is N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide.
What is the SMILES notation for N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide?
The canonical SMILES for N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide is NNc1ccc(C(=O)NCCOC2CCCC2)nn1.
What is the InChIKey of N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide?
The InChIKey is PGQFHOMZBQIQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c13-15-11-6-5-10(16-17-11)12(18)14-7-8-19-9-3-1-2-4-9/h5-6,9H,1-4,7-8,13H2,(H,14,18)(H,15,17).
What are the key properties of N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide?
N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 0.45, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyloxyethyl)-6-hydrazinylpyridazine-3-carboxamide is sourced from PubChem (CID 63832738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).