4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide

C15H17N3O3 — CID 8553881

IUPAC4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1nn(-c2ccccc2)c(=O)cc1OC
InChIInChI=1S/C15H17N3O3/c1-3-9-16-15(20)14-12(21-2)10-13(19)18(17-14)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,16,20)
InChIKeyBQNYTWKSNGYHRQ-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.38
Rot. Bonds5

About 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide

4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide (PubChem CID 8553881) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide.

Molecular Properties

Compound Name4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide
PubChem CID8553881
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1nn(-c2ccccc2)c(=O)cc1OC
InChIInChI=1S/C15H17N3O3/c1-3-9-16-15(20)14-12(21-2)10-13(19)18(17-14)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,16,20)
InChIKeyBQNYTWKSNGYHRQ-UHFFFAOYSA-N
XLogP1.38
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-butan-2-yl]-4-methoxy-6-oxo-1-phenylpyridazine-3-carboxamide
CID 8552987
1-(4-fluorophenyl)-4-methoxy-6-oxo-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 8557178
N-[(4-chlorophenyl)methyl]-4-methoxy-6-oxo-1-phenylpyridazine-3-carboxamide
CID 8553924
N-benzhydryl-4-methoxy-6-oxo-1-phenylpyridazine-3-carboxamide
CID 26842143
N-(2-hydroxyphenyl)-4-methoxy-6-oxo-1-phenylpyridazine-3-carboxamide
CID 8553640
4-methoxy-N,N-bis(2-methylpropyl)-6-oxo-1-phenylpyridazine-3-carboxamide
CID 8554268
4-methoxy-1-(4-methylphenyl)-6-oxo-N-[(1S)-1-phenylethyl]pyridazine-3-carboxamide
CID 8556306
N-(2-ethylphenyl)-1-(4-fluorophenyl)-4-methoxy-6-oxopyridazine-3-carboxamide
CID 8557124
3-(3,4-dimethylphenyl)-1-phenyl-N-propylpyrazole-5-carboxamide
CID 42754882
N-(4-fluoro-3-nitrophenyl)-4-methoxy-6-oxo-1-phenylpyridazine-3-carboxamide
CID 8553999
ethyl 1-(3-bromophenyl)-4-methoxy-6-oxopyridazine-3-carboxylate
CID 7386837
6-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]-5-methoxy-2-phenylpyridazin-3-one
CID 8553180

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide?
The IUPAC name of 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide (CID 8553881) is 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide.
What is the SMILES notation for 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide?
The canonical SMILES for 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide is CCCNC(=O)c1nn(-c2ccccc2)c(=O)cc1OC.
What is the InChIKey of 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide?
The InChIKey is BQNYTWKSNGYHRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-3-9-16-15(20)14-12(21-2)10-13(19)18(17-14)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,16,20).
What are the key properties of 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide?
4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.38, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-oxo-1-phenyl-N-propylpyridazine-3-carboxamide is sourced from PubChem (CID 8553881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).