N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide

C19H18N2O3 — CID 110694477

IUPACN-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C19H18N2O3/c1-21-16-9-5-4-8-14(16)15(11-18(21)22)19(23)20-12-13-7-3-6-10-17(13)24-2/h3-11H,12H2,1-2H3,(H,20,23)
InChIKeyHKNRFYANEGJKAM-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.48
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide

N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide (PubChem CID 110694477) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide
PubChem CID110694477
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide
SMILESCOc1ccccc1CNC(=O)c1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C19H18N2O3/c1-21-16-9-5-4-8-14(16)15(11-18(21)22)19(23)20-12-13-7-3-6-10-17(13)24-2/h3-11H,12H2,1-2H3,(H,20,23)
InChIKeyHKNRFYANEGJKAM-UHFFFAOYSA-N
XLogP2.48
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-[(4-methylphenyl)methyl]-2-oxoquinoline-4-carboxamide
CID 110694470
2-(1,2-dimethylindol-3-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 110768838
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
2-methoxy-N-[(2-methoxyphenyl)methyl]-3,5-dimethylbenzamide
CID 110762822
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065
N-(2-ethoxyphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694536
N-[(2,4-dimethoxyphenyl)methyl]-2-(1-methyl-2-oxoquinolin-4-yl)oxyacetamide
CID 20861851
N-[(2-methoxyphenyl)methyl]-1-methyl-4-propan-2-ylpyrrolo[3,2-b]indole-2-carboxamide
CID 97361374
4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide
CID 110761590
5-fluoro-2-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 31069159
1-methyl-2-oxo-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]quinoline-4-carboxamide
CID 122558905

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide (CID 110694477) is N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide is COc1ccccc1CNC(=O)c1cc(=O)n(C)c2ccccc12.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
The InChIKey is HKNRFYANEGJKAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-21-16-9-5-4-8-14(16)15(11-18(21)22)19(23)20-12-13-7-3-6-10-17(13)24-2/h3-11H,12H2,1-2H3,(H,20,23).
What are the key properties of N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide?
N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-1-methyl-2-oxoquinoline-4-carboxamide is sourced from PubChem (CID 110694477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).