N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

C19H17N3O3 — CID 6460302

IUPACN-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESCOc1cccc(NC(=O)Cn2nc(-c3ccccc3)ccc2=O)c1
InChIInChI=1S/C19H17N3O3/c1-25-16-9-5-8-15(12-16)20-18(23)13-22-19(24)11-10-17(21-22)14-6-3-2-4-7-14/h2-12H,13H2,1H3,(H,20,23)
InChIKeyCYDKQFXHFYEJQZ-UHFFFAOYSA-N
MW335.36 g/mol
LogP2.56
Rot. Bonds5

About N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (PubChem CID 6460302) has the molecular formula C19H17N3O3 and a molecular weight of 335.36 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
PubChem CID6460302
Molecular FormulaC19H17N3O3
Molecular Weight335.36 g/mol
Exact Mass335.13
IUPAC NameN-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESCOc1cccc(NC(=O)Cn2nc(-c3ccccc3)ccc2=O)c1
InChIInChI=1S/C19H17N3O3/c1-25-16-9-5-8-15(12-16)20-18(23)13-22-19(24)11-10-17(21-22)14-6-3-2-4-7-14/h2-12H,13H2,1H3,(H,20,23)
InChIKeyCYDKQFXHFYEJQZ-UHFFFAOYSA-N
XLogP2.56
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (CID 6460302) is N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is COc1cccc(NC(=O)Cn2nc(-c3ccccc3)ccc2=O)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The InChIKey is CYDKQFXHFYEJQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3/c1-25-16-9-5-8-15(12-16)20-18(23)13-22-19(24)11-10-17(21-22)14-6-3-2-4-7-14/h2-12H,13H2,1H3,(H,20,23).
What are the key properties of N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide has a molecular weight of 335.36 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is sourced from PubChem (CID 6460302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).