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

C20H17N5O2 — CID 60555015

IUPAC5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide
SMILESCC1N=C(C(=O)Nc2ccc3ncccc3c2)NN(c2ccccc2)C1=O
InChIInChI=1S/C20H17N5O2/c1-13-20(27)25(16-7-3-2-4-8-16)24-18(22-13)19(26)23-15-9-10-17-14(12-15)6-5-11-21-17/h2-13H,1H3,(H,22,24)(H,23,26)
InChIKeyBBMLIEJMSUVWOY-UHFFFAOYSA-N
MW359.39 g/mol
LogP2.51
Rot. Bonds3

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

5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide (PubChem CID 60555015) 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-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide.

Molecular Properties

Compound Name5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide
PubChem CID60555015
Molecular FormulaC20H17N5O2
Molecular Weight359.39 g/mol
Exact Mass359.14
IUPAC Name5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide
SMILESCC1N=C(C(=O)Nc2ccc3ncccc3c2)NN(c2ccccc2)C1=O
InChIInChI=1S/C20H17N5O2/c1-13-20(27)25(16-7-3-2-4-8-16)24-18(22-13)19(26)23-15-9-10-17-14(12-15)6-5-11-21-17/h2-13H,1H3,(H,22,24)(H,23,26)
InChIKeyBBMLIEJMSUVWOY-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-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide with MolForge

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Related Compounds

5-methyl-6-oxo-1-phenyl-N-quinolin-8-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide
CID 55602269
N-[4-chloro-3-(methylcarbamoyl)phenyl]-5-methyl-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide
CID 55990741
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-quinolin-6-ylbenzamide
CID 833617
5-methyl-N-[2-methyl-4-(methylcarbamoyl)phenyl]-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide
CID 55963053
(5R)-N-[(2R)-1-methoxypropan-2-yl]-5-methyl-6-oxo-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide
CID 39900316
5-methyl-1-phenyl-3-[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazine-1-carbonyl]-2,5-dihydro-1,2,4-triazin-6-one
CID 56535793
4-methyl-N-quinolin-6-ylpiperidine-2-carboxamide
CID 114423932
2,3-dimethyl-4-oxo-4-(quinolin-6-ylamino)butanoic acid
CID 103498293
N-quinolin-6-yl-3-sulfanylbenzamide
CID 107028522
4-oxo-N-quinolin-6-yl-3H-phthalazine-1-carboxamide
CID 60555807
N,N'-di(quinolin-6-yl)propanediamide
CID 2837594

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
The IUPAC name of 5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide (CID 60555015) is 5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide.
What is the SMILES notation for 5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
The canonical SMILES for 5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide is CC1N=C(C(=O)Nc2ccc3ncccc3c2)NN(c2ccccc2)C1=O.
What is the InChIKey of 5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
The InChIKey is BBMLIEJMSUVWOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O2/c1-13-20(27)25(16-7-3-2-4-8-16)24-18(22-13)19(26)23-15-9-10-17-14(12-15)6-5-11-21-17/h2-13H,1H3,(H,22,24)(H,23,26).
What are the key properties of 5-methyl-6-oxo-1-phenyl-N-quinolin-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide?
5-methyl-6-oxo-1-phenyl-N-quinolin-6-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-6-yl-2,5-dihydro-1,2,4-triazine-3-carboxamide is sourced from PubChem (CID 60555015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).