2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide

C19H19N3O5 — CID 7741631

IUPAC2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)Cn2cnc3ccccc3c2=O)cc(OC)c1OC
InChIInChI=1S/C19H19N3O5/c1-25-15-8-12(9-16(26-2)18(15)27-3)21-17(23)10-22-11-20-14-7-5-4-6-13(14)19(22)24/h4-9,11H,10H2,1-3H3,(H,21,23)
InChIKeyVMNPMIOHQLLEBA-UHFFFAOYSA-N
MW369.38 g/mol
LogP2.06
Rot. Bonds6

About 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide

2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide (PubChem CID 7741631) has the molecular formula C19H19N3O5 and a molecular weight of 369.38 g/mol. Its IUPAC name is 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
PubChem CID7741631
Molecular FormulaC19H19N3O5
Molecular Weight369.38 g/mol
Exact Mass369.13
IUPAC Name2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)Cn2cnc3ccccc3c2=O)cc(OC)c1OC
InChIInChI=1S/C19H19N3O5/c1-25-15-8-12(9-16(26-2)18(15)27-3)21-17(23)10-22-11-20-14-7-5-4-6-13(14)19(22)24/h4-9,11H,10H2,1-3H3,(H,21,23)
InChIKeyVMNPMIOHQLLEBA-UHFFFAOYSA-N
XLogP2.06
TPSA91.68 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]-N-(3,4,5-trimethoxyphenyl)acetamide
CID 5048859
3-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 26835382
N-[4-methoxy-3-(pyridin-4-ylmethoxy)phenyl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 46426810
N-(3,4-dimethylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 852114
2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 26465780
N-(2-ethoxypyrimidin-5-yl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 122302050
N-(3-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 2904511
N-(3-chloro-2-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 21231739
N-(4-bromophenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 988636
N-(2-methoxydibenzofuran-3-yl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 2684570
2-methyl-N-[4-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]phenyl]propanamide
CID 42119047
3-methyl-N-[4-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]phenyl]butanamide
CID 33026865

Frequently Asked Questions

What is the IUPAC name of 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The IUPAC name of 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide (CID 7741631) is 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The canonical SMILES for 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide is COc1cc(NC(=O)Cn2cnc3ccccc3c2=O)cc(OC)c1OC.
What is the InChIKey of 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
The InChIKey is VMNPMIOHQLLEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O5/c1-25-15-8-12(9-16(26-2)18(15)27-3)21-17(23)10-22-11-20-14-7-5-4-6-13(14)19(22)24/h4-9,11H,10H2,1-3H3,(H,21,23).
What are the key properties of 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide?
2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide has a molecular weight of 369.38 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)acetamide is sourced from PubChem (CID 7741631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).