N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide

C10H15N3O2 — CID 115769407

IUPACN-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide
SMILESCC(C)C(O)CNC(=O)c1ccnnc1
InChIInChI=1S/C10H15N3O2/c1-7(2)9(14)6-11-10(15)8-3-4-12-13-5-8/h3-5,7,9,14H,6H2,1-2H3,(H,11,15)
InChIKeyVKVCPZLEVXDBSJ-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.22
Rot. Bonds4

About N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide

N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide (PubChem CID 115769407) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide
PubChem CID115769407
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide
SMILESCC(C)C(O)CNC(=O)c1ccnnc1
InChIInChI=1S/C10H15N3O2/c1-7(2)9(14)6-11-10(15)8-3-4-12-13-5-8/h3-5,7,9,14H,6H2,1-2H3,(H,11,15)
InChIKeyVKVCPZLEVXDBSJ-UHFFFAOYSA-N
XLogP0.22
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-2-[(pyridazine-4-carbonylamino)methyl]butanoic acid
CID 104669732
N-(3-amino-2-hydroxy-3-oxopropyl)pyridazine-4-carboxamide
CID 106164807
6-fluoro-N-(2-hydroxy-3-methylbutyl)pyridine-3-carboxamide
CID 115746110
N-propan-2-ylpyridazine-4-carboxamide
CID 115736010
N-[3-(2-methylpropylcarbamoyl)phenyl]pyridazine-4-carboxamide
CID 131898619
N-(2-methoxyethyl)pyridazine-4-carboxamide
CID 143705997
(2S)-2-hydroxy-4-(pyridazine-4-carbonylamino)butanoic acid
CID 107834971
N-(1-chloropropan-2-yl)pyridazine-4-carboxamide
CID 104672603
3,5-dibromo-N-(2-hydroxy-3-methylbutyl)benzamide
CID 113349811
N-(4-aminobutan-2-yl)pyridazine-4-carboxamide
CID 104668958
pyridazine-4-carbohydrazide;hydrochloride
CID 122236542
5,6-dichloro-N-(2-hydroxy-3-methylbutyl)pyridine-3-carboxamide
CID 115746097

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide?
The IUPAC name of N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide (CID 115769407) is N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide?
The canonical SMILES for N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide is CC(C)C(O)CNC(=O)c1ccnnc1.
What is the InChIKey of N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide?
The InChIKey is VKVCPZLEVXDBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7(2)9(14)6-11-10(15)8-3-4-12-13-5-8/h3-5,7,9,14H,6H2,1-2H3,(H,11,15).
What are the key properties of N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide?
N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-methylbutyl)pyridazine-4-carboxamide is sourced from PubChem (CID 115769407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).