3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide

C19H19N3O3 — CID 110712281

IUPAC3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCCc2nc3ccccc3c(=O)n2C)c1
InChIInChI=1S/C19H19N3O3/c1-22-17(21-16-9-4-3-8-15(16)19(22)24)10-11-20-18(23)13-6-5-7-14(12-13)25-2/h3-9,12H,10-11H2,1-2H3,(H,20,23)
InChIKeyGSCGSJMRVDYLTK-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.91
Rot. Bonds5

About 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide

3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide (PubChem CID 110712281) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide
PubChem CID110712281
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCCc2nc3ccccc3c(=O)n2C)c1
InChIInChI=1S/C19H19N3O3/c1-22-17(21-16-9-4-3-8-15(16)19(22)24)10-11-20-18(23)13-6-5-7-14(12-13)25-2/h3-9,12H,10-11H2,1-2H3,(H,20,23)
InChIKeyGSCGSJMRVDYLTK-UHFFFAOYSA-N
XLogP1.91
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-2-phenoxyacetamide
CID 110712288
2-(3-fluorophenyl)-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide
CID 110712309
N-[2-[1-[3-(3-methoxyphenoxy)propyl]benzimidazol-2-yl]ethyl]benzamide
CID 16975792
N-[2-(4-methoxyphenoxy)ethyl]-3-(3-methyl-4-oxoquinazolin-2-yl)propanamide
CID 8935859
3-methoxy-N-[2-[1-[3-(3-methylphenoxy)propyl]benzimidazol-2-yl]ethyl]benzamide
CID 16978144
3-methoxy-N-[2-[1-[4-(2-methylphenoxy)butyl]benzimidazol-2-yl]ethyl]benzamide
CID 16978161
N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 110741916
3,3-dimethyl-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]butanamide
CID 110712301
3-methoxy-N-[2-(2-methylbenzimidazol-1-yl)ethyl]benzamide
CID 40716416
N-[2-(3-methoxyphenyl)ethyl]-1,3-dimethyl-2-oxoquinoxaline-6-carboxamide
CID 53003089
N-[2-[1-[2-[benzyl(propan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]ethyl]-3-methoxybenzamide
CID 16978211
N-[2-[1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]benzimidazol-2-yl]ethyl]-3-methoxybenzamide
CID 16978147

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide?
The IUPAC name of 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide (CID 110712281) is 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide?
The canonical SMILES for 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide is COc1cccc(C(=O)NCCc2nc3ccccc3c(=O)n2C)c1.
What is the InChIKey of 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide?
The InChIKey is GSCGSJMRVDYLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-22-17(21-16-9-4-3-8-15(16)19(22)24)10-11-20-18(23)13-6-5-7-14(12-13)25-2/h3-9,12H,10-11H2,1-2H3,(H,20,23).
What are the key properties of 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide?
3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide has a molecular weight of 337.38 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide is sourced from PubChem (CID 110712281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).