6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide

C21H18N4O3 — CID 110623360

IUPAC6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)N(C(=O)c1cccnc1)CCC2)c1ccc(=O)[nH]c1
InChIInChI=1S/C21H18N4O3/c26-19-8-6-15(13-23-19)20(27)24-17-7-5-14-4-2-10-25(18(14)11-17)21(28)16-3-1-9-22-12-16/h1,3,5-9,11-13H,2,4,10H2,(H,23,26)(H,24,27)
InChIKeyYLRDRQXOYTUTRP-UHFFFAOYSA-N
MW374.40 g/mol
LogP2.62
Rot. Bonds3

About 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide

6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide (PubChem CID 110623360) has the molecular formula C21H18N4O3 and a molecular weight of 374.40 g/mol. Its IUPAC name is 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide
PubChem CID110623360
Molecular FormulaC21H18N4O3
Molecular Weight374.40 g/mol
Exact Mass374.14
IUPAC Name6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)N(C(=O)c1cccnc1)CCC2)c1ccc(=O)[nH]c1
InChIInChI=1S/C21H18N4O3/c26-19-8-6-15(13-23-19)20(27)24-17-7-5-14-4-2-10-25(18(14)11-17)21(28)16-3-1-9-22-12-16/h1,3,5-9,11-13H,2,4,10H2,(H,23,26)(H,24,27)
InChIKeyYLRDRQXOYTUTRP-UHFFFAOYSA-N
XLogP2.62
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide with MolForge

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Related Compounds

N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]pyridine-4-carboxamide
CID 112506253
4-methyl-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]benzamide
CID 112505958
N-(1-acetyl-2,3-dihydroindol-6-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 110627246
2-amino-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]acetamide
CID 22689805
N-(6-oxo-1H-pyridin-3-yl)pyridine-3-carboxamide
CID 110724902
2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide
CID 110623614
1-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]ethanone
CID 110737710
(2S)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]oxolane-2-carboxamide
CID 42344151
ethyl 2-oxo-2-[[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]amino]acetate
CID 112506255
1-(2-methoxyethyl)-3-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]urea
CID 110303998
1-butan-2-yl-3-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]urea
CID 110623609
N-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-4-nitrobenzamide
CID 16835048

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide?
The IUPAC name of 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide (CID 110623360) is 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide is O=C(Nc1ccc2c(c1)N(C(=O)c1cccnc1)CCC2)c1ccc(=O)[nH]c1.
What is the InChIKey of 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide?
The InChIKey is YLRDRQXOYTUTRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O3/c26-19-8-6-15(13-23-19)20(27)24-17-7-5-14-4-2-10-25(18(14)11-17)21(28)16-3-1-9-22-12-16/h1,3,5-9,11-13H,2,4,10H2,(H,23,26)(H,24,27).
What are the key properties of 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide?
6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide has a molecular weight of 374.40 g/mol, XLogP of 2.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110623360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).