6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide

C11H18N4O2 — CID 114131484

IUPAC6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide
SMILESCOCCCCCNC(=O)c1ccc(N)nn1
InChIInChI=1S/C11H18N4O2/c1-17-8-4-2-3-7-13-11(16)9-5-6-10(12)15-14-9/h5-6H,2-4,7-8H2,1H3,(H2,12,15)(H,13,16)
InChIKeyQWKWTKFCVCUYLZ-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.61
Rot. Bonds7

About 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide

6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide (PubChem CID 114131484) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide
PubChem CID114131484
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide
SMILESCOCCCCCNC(=O)c1ccc(N)nn1
InChIInChI=1S/C11H18N4O2/c1-17-8-4-2-3-7-13-11(16)9-5-6-10(12)15-14-9/h5-6H,2-4,7-8H2,1H3,(H2,12,15)(H,13,16)
InChIKeyQWKWTKFCVCUYLZ-UHFFFAOYSA-N
XLogP0.61
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-amino-N-[3-[methyl(propan-2-yl)amino]propyl]pyridazine-3-carboxamide
CID 106050158
N-(2-acetamidoethyl)-6-aminopyridazine-3-carboxamide
CID 62154293
6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 62238827
6-amino-N-(2-methylsulfonylethyl)pyridazine-3-carboxamide
CID 62153010
5-carbamothioyl-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 63748322
5-amino-6-(5-methoxypentylamino)pyridine-2-carboxamide
CID 114131934
5-amino-6-(4-methoxybutylamino)pyridine-2-carboxamide
CID 114406169
6-[2-(4-fluorophenyl)ethylamino]-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114295
3-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 104742127
6-(3-methoxypropylamino)-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109114110
N-(2-methoxyethyl)-6-propan-2-ylpyridazine-3-carboxamide
CID 113200331
5-(4-methoxybutylcarbamoyl)pyridine-2-carboxylic acid
CID 60769978

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide?
The IUPAC name of 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide (CID 114131484) is 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide is COCCCCCNC(=O)c1ccc(N)nn1.
What is the InChIKey of 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide?
The InChIKey is QWKWTKFCVCUYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-17-8-4-2-3-7-13-11(16)9-5-6-10(12)15-14-9/h5-6H,2-4,7-8H2,1H3,(H2,12,15)(H,13,16).
What are the key properties of 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide?
6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.61, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide is sourced from PubChem (CID 114131484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).