N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide

C18H17N3O3 — CID 663370

IUPACN-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide
SMILESCOc1ccc2[nH]c(=O)c(CN(C)C(=O)c3ccncc3)cc2c1
InChIInChI=1S/C18H17N3O3/c1-21(18(23)12-5-7-19-8-6-12)11-14-9-13-10-15(24-2)3-4-16(13)20-17(14)22/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyYUMYPBDOPOHTHJ-UHFFFAOYSA-N
MW323.35 g/mol
LogP2.20
Rot. Bonds4

About N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide

N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide (PubChem CID 663370) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide
PubChem CID663370
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide
SMILESCOc1ccc2[nH]c(=O)c(CN(C)C(=O)c3ccncc3)cc2c1
InChIInChI=1S/C18H17N3O3/c1-21(18(23)12-5-7-19-8-6-12)11-14-9-13-10-15(24-2)3-4-16(13)20-17(14)22/h3-10H,11H2,1-2H3,(H,20,22)
InChIKeyYUMYPBDOPOHTHJ-UHFFFAOYSA-N
XLogP2.20
TPSA75.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide?
The IUPAC name of N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide (CID 663370) is N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide is COc1ccc2[nH]c(=O)c(CN(C)C(=O)c3ccncc3)cc2c1.
What is the InChIKey of N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide?
The InChIKey is YUMYPBDOPOHTHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-21(18(23)12-5-7-19-8-6-12)11-14-9-13-10-15(24-2)3-4-16(13)20-17(14)22/h3-10H,11H2,1-2H3,(H,20,22).
What are the key properties of N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide?
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide has a molecular weight of 323.35 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 663370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).