6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide

C23H22N4O2 — CID 60609063

IUPAC6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide
SMILESCCCn1ccc2cc(NC(=O)c3nn(-c4ccccc4)c(C)cc3=O)ccc21
InChIInChI=1S/C23H22N4O2/c1-3-12-26-13-11-17-15-18(9-10-20(17)26)24-23(29)22-21(28)14-16(2)27(25-22)19-7-5-4-6-8-19/h4-11,13-15H,3,12H2,1-2H3,(H,24,29)
InChIKeyOWDBEFOVUCKUDI-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.16
Rot. Bonds5

About 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide

6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide (PubChem CID 60609063) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide
PubChem CID60609063
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC Name6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide
SMILESCCCn1ccc2cc(NC(=O)c3nn(-c4ccccc4)c(C)cc3=O)ccc21
InChIInChI=1S/C23H22N4O2/c1-3-12-26-13-11-17-15-18(9-10-20(17)26)24-23(29)22-21(28)14-16(2)27(25-22)19-7-5-4-6-8-19/h4-11,13-15H,3,12H2,1-2H3,(H,24,29)
InChIKeyOWDBEFOVUCKUDI-UHFFFAOYSA-N
XLogP4.16
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 9078101
N-(1-propylindol-5-yl)-1H-indazole-3-carboxamide
CID 60607032
N-(3-methoxyphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 17399746
6-methyl-N-(4-methylsulfanylphenyl)-4-oxo-1-phenylpyridazine-3-carboxamide
CID 8810913
N-[4-(cyanomethyl)phenyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 27163514
N-(2-ethylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 8565302
methyl 2-chloro-5-[(6-methyl-4-oxo-1-phenylpyridazine-3-carbonyl)amino]benzoate
CID 34161619
N-[2-(ethylamino)-2-oxoethyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 86909633
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 55515849
6-methyl-4-oxo-1-phenyl-N-[4-(1,3-thiazol-2-yl)phenyl]pyridazine-3-carboxamide
CID 55427141
N-[4-(difluoromethoxy)-3-(4-methoxyphenyl)phenyl]-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 26703269
N-(2-hydroxy-4-methylphenyl)-6-methyl-4-oxo-1-phenylpyridazine-3-carboxamide
CID 51073720

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide?
The IUPAC name of 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide (CID 60609063) is 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide?
The canonical SMILES for 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide is CCCn1ccc2cc(NC(=O)c3nn(-c4ccccc4)c(C)cc3=O)ccc21.
What is the InChIKey of 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide?
The InChIKey is OWDBEFOVUCKUDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-3-12-26-13-11-17-15-18(9-10-20(17)26)24-23(29)22-21(28)14-16(2)27(25-22)19-7-5-4-6-8-19/h4-11,13-15H,3,12H2,1-2H3,(H,24,29).
What are the key properties of 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide?
6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide has a molecular weight of 386.46 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-oxo-1-phenyl-N-(1-propylindol-5-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 60609063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).