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

C20H21N3O2 — CID 46550497

IUPACN-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide
SMILESCCN(C(=O)Cn1cnc2c(C)cccc2c1=O)c1ccccc1C
InChIInChI=1S/C20H21N3O2/c1-4-23(17-11-6-5-8-14(17)2)18(24)12-22-13-21-19-15(3)9-7-10-16(19)20(22)25/h5-11,13H,4,12H2,1-3H3
InChIKeyKKFBFIUDRQLDFR-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.07
Rot. Bonds4

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

N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide (PubChem CID 46550497) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide
PubChem CID46550497
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide
SMILESCCN(C(=O)Cn1cnc2c(C)cccc2c1=O)c1ccccc1C
InChIInChI=1S/C20H21N3O2/c1-4-23(17-11-6-5-8-14(17)2)18(24)12-22-13-21-19-15(3)9-7-10-16(19)20(22)25/h5-11,13H,4,12H2,1-3H3
InChIKeyKKFBFIUDRQLDFR-UHFFFAOYSA-N
XLogP3.07
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide?
The IUPAC name of N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide (CID 46550497) is N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide?
The canonical SMILES for N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide is CCN(C(=O)Cn1cnc2c(C)cccc2c1=O)c1ccccc1C.
What is the InChIKey of N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide?
The InChIKey is KKFBFIUDRQLDFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-4-23(17-11-6-5-8-14(17)2)18(24)12-22-13-21-19-15(3)9-7-10-16(19)20(22)25/h5-11,13H,4,12H2,1-3H3.
What are the key properties of N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide?
N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide has a molecular weight of 335.41 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 46550497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).