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

C19H18N2O3 — CID 110666080

IUPAC3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
SMILESCOc1cccc(C(=O)NCc2ccc3[nH]c(=O)c(C)cc3c2)c1
InChIInChI=1S/C19H18N2O3/c1-12-8-15-9-13(6-7-17(15)21-18(12)22)11-20-19(23)14-4-3-5-16(10-14)24-2/h3-10H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyKQGRPPAOSOPBMG-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.78
Rot. Bonds4

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

3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide (PubChem CID 110666080) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
PubChem CID110666080
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
SMILESCOc1cccc(C(=O)NCc2ccc3[nH]c(=O)c(C)cc3c2)c1
InChIInChI=1S/C19H18N2O3/c1-12-8-15-9-13(6-7-17(15)21-18(12)22)11-20-19(23)14-4-3-5-16(10-14)24-2/h3-10H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyKQGRPPAOSOPBMG-UHFFFAOYSA-N
XLogP2.78
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
CID 110666082
3,4-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
CID 110666084
2,6-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
CID 110666083
N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]-3H-benzimidazole-5-carboxamide
CID 110666044
4-(dimethylamino)-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
CID 110666046
3-N-[(3-methoxyphenyl)methyl]-1-N-[(4-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
CID 10272573
N-[(3-hydroxyphenyl)methyl]-3-methoxybenzamide
CID 47292174
N-[(4-ethoxy-3-methylphenyl)methyl]-3-methoxybenzamide
CID 110781923
3-(2-methoxyphenyl)-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]propanamide
CID 110666107
3-chloro-N-[(2-methyl-1H-indol-5-yl)methyl]benzamide
CID 5096420
N-[(2,3-dimethylphenyl)methyl]-6-methoxy-2-oxo-1H-quinoline-3-carboxamide
CID 167894443
N-[[4-(dimethylamino)phenyl]methyl]-3-methoxybenzamide
CID 17462321

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
The IUPAC name of 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide (CID 110666080) is 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
The canonical SMILES for 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide is COc1cccc(C(=O)NCc2ccc3[nH]c(=O)c(C)cc3c2)c1.
What is the InChIKey of 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
The InChIKey is KQGRPPAOSOPBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-12-8-15-9-13(6-7-17(15)21-18(12)22)11-20-19(23)14-4-3-5-16(10-14)24-2/h3-10H,11H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide has a molecular weight of 322.36 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide is sourced from PubChem (CID 110666080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).