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

C17H19N3O2 — CID 56816991

IUPACN-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCN1CCC(CNC(=O)c2ccc(=O)[nH]c2)c2ccccc21
InChIInChI=1S/C17H19N3O2/c1-20-9-8-12(14-4-2-3-5-15(14)20)10-19-17(22)13-6-7-16(21)18-11-13/h2-7,11-12H,8-10H2,1H3,(H,18,21)(H,19,22)
InChIKeyXRAMQZUKVVTTPU-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.73
Rot. Bonds3

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

N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 56816991) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID56816991
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCN1CCC(CNC(=O)c2ccc(=O)[nH]c2)c2ccccc21
InChIInChI=1S/C17H19N3O2/c1-20-9-8-12(14-4-2-3-5-15(14)20)10-19-17(22)13-6-7-16(21)18-11-13/h2-7,11-12H,8-10H2,1H3,(H,18,21)(H,19,22)
InChIKeyXRAMQZUKVVTTPU-UHFFFAOYSA-N
XLogP1.73
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Propanamide, N-(1-ethyl-1,2,3,4-tetrahydro-2,2,4-trimethyl-7-quinolinyl)-
CID 112580
1-Propionyl-1,2,3,4-tetrahydroquinoline
CID 583808
N-(2-Hydroxy-quinolin-4-ylmethyl)-N-phenyl-propionamide
CID 943545
Iferanserin
CID 6445539
4-Methyl-5,6-dihydro-pyrido[1,2-a]quinolin-3-one
CID 12969973
N-(1-phenyl-3,4-dihydro-2H-quinolin-3-yl)propanamide
CID 137637884
N-[(1-phenyl-3,4-dihydro-2H-quinolin-3-yl)methyl]acetamide
CID 137641357
N-[4-(3,4-Dihydro-2H-quinoline-1-carbonyl)-phenyl]-acetamide
CID 669479
N-(2-methyl-1-propanoyl-3,4-dihydro-2H-quinolin-4-yl)-N-phenylpropanamide
CID 3103979
N-tert-butyl-N-[2-(tert-butylamino)-2-oxoethyl]-3-(3,4-dihydro-2H-quinolin-1-yl)propanamide
CID 648838
N-[(1-benzyl-3,4-dihydro-2H-quinolin-2-yl)methyl]propanamide
CID 122188235
N-[(1-benzyl-3,4-dihydro-2H-quinolin-2-yl)methyl]acetamide
CID 122188236

Frequently Asked Questions

What is the IUPAC name of N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide (CID 56816991) is N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide is CN1CCC(CNC(=O)c2ccc(=O)[nH]c2)c2ccccc21.
What is the InChIKey of N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is XRAMQZUKVVTTPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-20-9-8-12(14-4-2-3-5-15(14)20)10-19-17(22)13-6-7-16(21)18-11-13/h2-7,11-12H,8-10H2,1H3,(H,18,21)(H,19,22).
What are the key properties of N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide?
N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methyl-3,4-dihydro-2H-quinolin-4-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 56816991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).