2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide

C21H18N4O2 — CID 166369977

IUPAC2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide
SMILESO=C1CCc2ccc(C(=O)NCc3cccc(-c4ccccn4)n3)cc2N1
InChIInChI=1S/C21H18N4O2/c26-20-10-9-14-7-8-15(12-19(14)25-20)21(27)23-13-16-4-3-6-18(24-16)17-5-1-2-11-22-17/h1-8,11-12H,9-10,13H2,(H,23,27)(H,25,26)
InChIKeyAIKUWLCZDKMYDR-UHFFFAOYSA-N
MW358.40 g/mol
LogP2.96
Rot. Bonds4

About 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide

2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide (PubChem CID 166369977) has the molecular formula C21H18N4O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide.

Molecular Properties

Compound Name2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide
PubChem CID166369977
Molecular FormulaC21H18N4O2
Molecular Weight358.40 g/mol
Exact Mass358.14
IUPAC Name2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide
SMILESO=C1CCc2ccc(C(=O)NCc3cccc(-c4ccccn4)n3)cc2N1
InChIInChI=1S/C21H18N4O2/c26-20-10-9-14-7-8-15(12-19(14)25-20)21(27)23-13-16-4-3-6-18(24-16)17-5-1-2-11-22-17/h1-8,11-12H,9-10,13H2,(H,23,27)(H,25,26)
InChIKeyAIKUWLCZDKMYDR-UHFFFAOYSA-N
XLogP2.96
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide with MolForge

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Related Compounds

N-(pyridin-2-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-7-carboxamide
CID 79015224
1-(7-fluoro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)-3-(pyridin-2-ylmethyl)urea
CID 99585746
2-oxo-N-(pyridin-4-ylmethyl)-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18107678
N-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]pyridine-2-carboxamide
CID 110793860
N-[(2-hydroxyphenyl)methyl]-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102712839
1-N-(pyridin-2-ylmethyl)-3-N-sulfanylbenzene-1,3-dicarboxamide
CID 143484238
N-[(2-fluorophenyl)methyl]-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102711893
N-(1H-benzimidazol-2-ylmethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18105228
N-(pyridin-2-ylmethyl)-1H-indole-5-carboxamide
CID 63716738
3-phenyl-N-(pyridin-2-ylmethyl)benzamide
CID 110724423
3-acetamido-N-(pyridin-2-ylmethyl)benzamide
CID 13177095
N-(pyridin-2-ylmethyl)-3-(pyrimidin-2-ylamino)benzamide
CID 31860864

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide?
The IUPAC name of 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide (CID 166369977) is 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide.
What is the SMILES notation for 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide?
The canonical SMILES for 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide is O=C1CCc2ccc(C(=O)NCc3cccc(-c4ccccn4)n3)cc2N1.
What is the InChIKey of 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide?
The InChIKey is AIKUWLCZDKMYDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O2/c26-20-10-9-14-7-8-15(12-19(14)25-20)21(27)23-13-16-4-3-6-18(24-16)17-5-1-2-11-22-17/h1-8,11-12H,9-10,13H2,(H,23,27)(H,25,26).
What are the key properties of 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide?
2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide has a molecular weight of 358.40 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-[(6-pyridin-2-yl-2-pyridinyl)methyl]-3,4-dihydro-1H-quinoline-7-carboxamide is sourced from PubChem (CID 166369977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).