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

C12H11N3O2 — CID 104670815

IUPACN-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide
SMILESCc1c(O)cccc1NC(=O)c1ccnnc1
InChIInChI=1S/C12H11N3O2/c1-8-10(3-2-4-11(8)16)15-12(17)9-5-6-13-14-7-9/h2-7,16H,1H3,(H,15,17)
InChIKeyNZBKDJNNZHRUCK-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.74
Rot. Bonds2

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

N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide (PubChem CID 104670815) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide
PubChem CID104670815
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide
SMILESCc1c(O)cccc1NC(=O)c1ccnnc1
InChIInChI=1S/C12H11N3O2/c1-8-10(3-2-4-11(8)16)15-12(17)9-5-6-13-14-7-9/h2-7,16H,1H3,(H,15,17)
InChIKeyNZBKDJNNZHRUCK-UHFFFAOYSA-N
XLogP1.74
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-hydroxy-2-methylphenyl)-1-phenyl-5-propylpyrazole-4-carboxamide
CID 118725456
N-(4-tert-butyl-2-hydroxyphenyl)pyridazine-4-carboxamide
CID 136540655
4-[2-(cyclopropylamino)-4-hydroxyphenyl]-1-[6-[(E)-1-fluorobut-2-enyl]pyridazin-4-yl]butan-1-one
CID 142397779
3-fluoro-N-(3-hydroxy-2-methylphenyl)pyridine-4-carboxamide
CID 64950294
2-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 108092487
6-fluoro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 113290192
5-fluoro-N-(3-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 113452884
3-methyl-N-[2-methyl-3-(2,2,2-trifluoroethoxy)phenyl]pyridazine-4-carboxamide
CID 136517427
N-(2-fluoro-4-hydroxyphenyl)pyridazine-4-carboxamide
CID 136808408
N-(3-fluoro-4-hydroxyphenyl)pyridazine-4-carboxamide
CID 136905893
N-(4-amino-3-benzyl-2-hydroxyphenyl)pyridazine-4-carboxamide
CID 140854722
N-(3-hydroxyphenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 19280648

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
The IUPAC name of N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide (CID 104670815) is N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
The canonical SMILES for N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide is Cc1c(O)cccc1NC(=O)c1ccnnc1.
What is the InChIKey of N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
The InChIKey is NZBKDJNNZHRUCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-8-10(3-2-4-11(8)16)15-12(17)9-5-6-13-14-7-9/h2-7,16H,1H3,(H,15,17).
What are the key properties of N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide?
N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide has a molecular weight of 229.24 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-methylphenyl)pyridazine-4-carboxamide is sourced from PubChem (CID 104670815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).