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

C17H17N3O2 — CID 166179612

IUPACN-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide
SMILESCC(NC(=O)c1cccnc1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H17N3O2/c1-11(19-17(22)14-3-2-8-18-10-14)12-4-6-15-13(9-12)5-7-16(21)20-15/h2-4,6,8-11H,5,7H2,1H3,(H,19,22)(H,20,21)
InChIKeyYQHCRNVIIYPHDH-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.46
Rot. Bonds3

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

N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide (PubChem CID 166179612) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide
PubChem CID166179612
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC NameN-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide
SMILESCC(NC(=O)c1cccnc1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C17H17N3O2/c1-11(19-17(22)14-3-2-8-18-10-14)12-4-6-15-13(9-12)5-7-16(21)20-15/h2-4,6,8-11H,5,7H2,1H3,(H,19,22)(H,20,21)
InChIKeyYQHCRNVIIYPHDH-UHFFFAOYSA-N
XLogP2.46
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(1R)-1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]amino]-N-pyridin-3-ylacetamide
CID 97333641
2-[[(1S)-1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]amino]-N-(pyridin-3-ylmethyl)acetamide
CID 97333628
3,4-diethoxy-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]benzamide
CID 60516922
6-(2,6-dimethylmorpholin-4-yl)-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide
CID 71940676
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18114889
N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 18143617
N-[1-(3,5-difluorophenyl)ethyl]pyridine-3-carboxamide
CID 140591732
1-amino-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]cyclopropane-1-carboxamide
CID 119729776
1-methyl-N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 51120389
N-[1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 4126174
6-(2-methyl-1-pyridin-3-ylbutyl)-3,4-dihydro-1H-quinolin-2-one
CID 19854649
1-[(6-methyl-3-pyridinyl)methyl]-3-[(1S)-1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]urea
CID 94115891

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide (CID 166179612) is N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide is CC(NC(=O)c1cccnc1)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is YQHCRNVIIYPHDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-11(19-17(22)14-3-2-8-18-10-14)12-4-6-15-13(9-12)5-7-16(21)20-15/h2-4,6,8-11H,5,7H2,1H3,(H,19,22)(H,20,21).
What are the key properties of N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide?
N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 295.34 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 166179612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).