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

C15H19N3O2 — CID 53159144

IUPACN-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide
SMILESCCn1c(CCNC(C)=O)nc2c(C)cccc2c1=O
InChIInChI=1S/C15H19N3O2/c1-4-18-13(8-9-16-11(3)19)17-14-10(2)6-5-7-12(14)15(18)20/h5-7H,4,8-9H2,1-3H3,(H,16,19)
InChIKeyFGADJANJGUENQY-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.40
Rot. Bonds4

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

N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide (PubChem CID 53159144) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide
PubChem CID53159144
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide
SMILESCCn1c(CCNC(C)=O)nc2c(C)cccc2c1=O
InChIInChI=1S/C15H19N3O2/c1-4-18-13(8-9-16-11(3)19)17-14-10(2)6-5-7-12(14)15(18)20/h5-7H,4,8-9H2,1-3H3,(H,16,19)
InChIKeyFGADJANJGUENQY-UHFFFAOYSA-N
XLogP1.40
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide?
The IUPAC name of N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide (CID 53159144) is N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide is CCn1c(CCNC(C)=O)nc2c(C)cccc2c1=O.
What is the InChIKey of N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide?
The InChIKey is FGADJANJGUENQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-18-13(8-9-16-11(3)19)17-14-10(2)6-5-7-12(14)15(18)20/h5-7H,4,8-9H2,1-3H3,(H,16,19).
What are the key properties of N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide?
N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide has a molecular weight of 273.34 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethyl-8-methyl-4-oxoquinazolin-2-yl)ethyl]acetamide is sourced from PubChem (CID 53159144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).