3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide

C20H20N2O4 — CID 110666082

IUPAC3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCc2ccc3[nH]c(=O)c(C)cc3c2)c1
InChIInChI=1S/C20H20N2O4/c1-12-6-14-7-13(4-5-18(14)22-19(12)23)11-21-20(24)15-8-16(25-2)10-17(9-15)26-3/h4-10H,11H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyQBAPRYRHKVLAIS-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.78
Rot. Bonds5

About 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide

3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide (PubChem CID 110666082) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
PubChem CID110666082
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Name3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCc2ccc3[nH]c(=O)c(C)cc3c2)c1
InChIInChI=1S/C20H20N2O4/c1-12-6-14-7-13(4-5-18(14)22-19(12)23)11-21-20(24)15-8-16(25-2)10-17(9-15)26-3/h4-10H,11H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyQBAPRYRHKVLAIS-UHFFFAOYSA-N
XLogP2.78
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
CID 110666080
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
4-(dimethylamino)-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide
CID 110666046
3,5-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
CID 835462
N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]-3H-benzimidazole-5-carboxamide
CID 110666044
3-(2-methoxyphenyl)-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]propanamide
CID 110666107
N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]cyclohexanecarboxamide
CID 110666063
N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methyl-2-oxo-1H-quinolin-6-yl)acetamide
CID 110300545
methyl 4-[[(3,5-dimethoxybenzoyl)amino]methyl]benzoate
CID 18106671
N-[(4-chlorophenyl)methyl]-3,5-dimethoxybenzamide
CID 1335598
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616680

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide (CID 110666082) is 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide is COc1cc(OC)cc(C(=O)NCc2ccc3[nH]c(=O)c(C)cc3c2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
The InChIKey is QBAPRYRHKVLAIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-12-6-14-7-13(4-5-18(14)22-19(12)23)11-21-20(24)15-8-16(25-2)10-17(9-15)26-3/h4-10H,11H2,1-3H3,(H,21,24)(H,22,23).
What are the key properties of 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide?
3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide has a molecular weight of 352.39 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[(3-methyl-2-oxo-1H-quinolin-6-yl)methyl]benzamide is sourced from PubChem (CID 110666082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).