2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide

C20H21N3O3 — CID 27895346

IUPAC2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide
SMILESCCCOc1ccccc1NC(=O)Cn1cnc2c(C)cccc2c1=O
InChIInChI=1S/C20H21N3O3/c1-3-11-26-17-10-5-4-9-16(17)22-18(24)12-23-13-21-19-14(2)7-6-8-15(19)20(23)25/h4-10,13H,3,11-12H2,1-2H3,(H,22,24)
InChIKeyWCUYLRPAXPQJRC-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.13
Rot. Bonds6

About 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide

2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide (PubChem CID 27895346) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide
PubChem CID27895346
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide
SMILESCCCOc1ccccc1NC(=O)Cn1cnc2c(C)cccc2c1=O
InChIInChI=1S/C20H21N3O3/c1-3-11-26-17-10-5-4-9-16(17)22-18(24)12-23-13-21-19-14(2)7-6-8-15(19)20(23)25/h4-10,13H,3,11-12H2,1-2H3,(H,22,24)
InChIKeyWCUYLRPAXPQJRC-UHFFFAOYSA-N
XLogP3.13
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyphenyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 17397655
2-(8-methyl-4-oxoquinazolin-3-yl)-N-quinolin-8-ylacetamide
CID 17443977
2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylsulfanylphenyl)acetamide
CID 24655621
N-[2-(azepan-1-yl)phenyl]-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 24660519
N-[3-[[2-(8-methyl-4-oxoquinazolin-3-yl)acetyl]amino]phenyl]butanamide
CID 87026199
N-(4-bromo-2-methylphenyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 51264976
N-(5-chloro-2-fluorophenyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 51265002
2-(8-methyl-4-oxoquinazolin-3-yl)-N-[(2R)-pentan-2-yl]acetamide
CID 41103569
N-(5-methyl-1,2-oxazol-3-yl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 27161523
N-(2-ethoxyphenyl)-2-(7-methyl-3-oxo-[1,2,4]triazolo[4,3-c]quinazolin-2-yl)acetamide
CID 53020247
N'-(2-fluorophenyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetohydrazide
CID 150829256
N-(1-methoxypropan-2-yl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 17397674

Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide?
The IUPAC name of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide (CID 27895346) is 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide?
The canonical SMILES for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide is CCCOc1ccccc1NC(=O)Cn1cnc2c(C)cccc2c1=O.
What is the InChIKey of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide?
The InChIKey is WCUYLRPAXPQJRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-3-11-26-17-10-5-4-9-16(17)22-18(24)12-23-13-21-19-14(2)7-6-8-15(19)20(23)25/h4-10,13H,3,11-12H2,1-2H3,(H,22,24).
What are the key properties of 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide?
2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide has a molecular weight of 351.41 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-propoxyphenyl)acetamide is sourced from PubChem (CID 27895346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).