5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide

C20H17N5O2 — CID 55602269

IUPAC5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide
SMILESCC1N=C(C(=O)Nc2cccc3cccnc23)NN(c2ccccc2)C1=O
InChIInChI=1S/C20H17N5O2/c1-13-20(27)25(15-9-3-2-4-10-15)24-18(22-13)19(26)23-16-11-5-7-14-8-6-12-21-17(14)16/h2-13H,1H3,(H,22,24)(H,23,26)
InChIKeySVLDZAATFHVQCI-UHFFFAOYSA-N
MW359.39 g/mol
LogP2.51
Rot. Bonds3

About 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide

5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide (PubChem CID 55602269) has the molecular formula C20H17N5O2 and a molecular weight of 359.39 g/mol. Its IUPAC name is 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide.

Molecular Properties

Compound Name5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide
PubChem CID55602269
Molecular FormulaC20H17N5O2
Molecular Weight359.39 g/mol
Exact Mass359.14
IUPAC Name5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide
SMILESCC1N=C(C(=O)Nc2cccc3cccnc23)NN(c2ccccc2)C1=O
InChIInChI=1S/C20H17N5O2/c1-13-20(27)25(15-9-3-2-4-10-15)24-18(22-13)19(26)23-16-11-5-7-14-8-6-12-21-17(14)16/h2-13H,1H3,(H,22,24)(H,23,26)
InChIKeySVLDZAATFHVQCI-UHFFFAOYSA-N
XLogP2.51
TPSA86.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide with MolForge

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Related Compounds

5-methyl-N-[2-methyl-4-(methylcarbamoyl)phenyl]-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide
CID 55963053
5-methyl-6-oxo-N-[3-(2-oxopyrrolidin-1-yl)phenyl]-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide
CID 43072459
N-[4-chloro-3-(methylcarbamoyl)phenyl]-5-methyl-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide
CID 55990741
2-(N-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109314256
2-N,5-N-di(quinolin-8-yl)thiophene-2,5-dicarboxamide
CID 23913298
4-(2-oxoimidazolidin-1-yl)-N-quinolin-8-ylbenzamide
CID 51299238
2-ethyl-3-oxo-5,6-diphenyl-N-quinolin-8-ylpyridazine-4-carboxamide
CID 108790850
2-methyl-N-quinolin-8-ylnaphthalene-1-carboxamide
CID 132837940
(1S,4S)-3-(quinolin-8-ylcarbamoyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2-carboxylic acid
CID 98512230
1,3-dimethyl-2-oxo-N-quinolin-8-ylbenzimidazole-5-carboxamide
CID 110765475
3-phenylmethoxy-N-quinolin-8-ylpyridine-2-carboxamide
CID 69444328
6-chloro-N-quinolin-8-ylpyridine-2-carboxamide
CID 62235243

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
The IUPAC name of 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide (CID 55602269) is 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide.
What is the SMILES notation for 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
The canonical SMILES for 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide is CC1N=C(C(=O)Nc2cccc3cccnc23)NN(c2ccccc2)C1=O.
What is the InChIKey of 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
The InChIKey is SVLDZAATFHVQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O2/c1-13-20(27)25(15-9-3-2-4-10-15)24-18(22-13)19(26)23-16-11-5-7-14-8-6-12-21-17(14)16/h2-13H,1H3,(H,22,24)(H,23,26).
What are the key properties of 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide has a molecular weight of 359.39 g/mol, XLogP of 2.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide is sourced from PubChem (CID 55602269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).