2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide

C12H11Cl2N3O2 — CID 2415100

IUPAC2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide
SMILESCCNC(=O)COc1ncnc2c(Cl)cc(Cl)cc12
InChIInChI=1S/C12H11Cl2N3O2/c1-2-15-10(18)5-19-12-8-3-7(13)4-9(14)11(8)16-6-17-12/h3-4,6H,2,5H2,1H3,(H,15,18)
InChIKeyILPHZQVCIBKIMJ-UHFFFAOYSA-N
MW300.14 g/mol
LogP2.45
Rot. Bonds4

About 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide

2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide (PubChem CID 2415100) has the molecular formula C12H11Cl2N3O2 and a molecular weight of 300.14 g/mol. Its IUPAC name is 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide.

Molecular Properties

Compound Name2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide
PubChem CID2415100
Molecular FormulaC12H11Cl2N3O2
Molecular Weight300.14 g/mol
Exact Mass299.02
IUPAC Name2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide
SMILESCCNC(=O)COc1ncnc2c(Cl)cc(Cl)cc12
InChIInChI=1S/C12H11Cl2N3O2/c1-2-15-10(18)5-19-12-8-3-7(13)4-9(14)11(8)16-6-17-12/h3-4,6H,2,5H2,1H3,(H,15,18)
InChIKeyILPHZQVCIBKIMJ-UHFFFAOYSA-N
XLogP2.45
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.14
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-2-(6,8-dichloroquinazolin-4-yl)oxyacetamide
CID 4262025
N-[(3-chlorophenyl)methyl]-2-(6,8-dichloroquinazolin-4-yl)oxyacetamide
CID 4641621
N-(tert-butylcarbamoyl)-2-(6,8-dichloroquinazolin-4-yl)oxyacetamide
CID 2704065
2-(6,8-dichloroquinazolin-4-yl)oxyacetamide
CID 2448568
2-(6,8-dichloroquinazolin-4-yl)oxy-N-(4-ethoxyphenyl)acetamide
CID 4310600
2-(6,8-dichloroquinazolin-4-yl)oxy-N-(2,5-dimethylphenyl)acetamide
CID 8012479
N-(benzylcarbamoyl)-2-(6,8-dichloroquinazolin-4-yl)oxyacetamide
CID 3440020
2-(6,8-dichloroquinazolin-4-yl)oxy-N-naphthalen-2-ylacetamide
CID 4005082
2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide
CID 2704087
N-(1-adamantylcarbamoyl)-2-(6,8-dichloroquinazolin-4-yl)oxyacetamide
CID 3950170
methyl 4-[(6,8-dichloroquinazolin-4-yl)oxymethyl]benzoate
CID 2426065
2-[2,4-dichloro-6-(hydroxymethyl)phenoxy]-N-ethylacetamide
CID 43516177

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide?
The IUPAC name of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide (CID 2415100) is 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide.
What is the SMILES notation for 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide?
The canonical SMILES for 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide is CCNC(=O)COc1ncnc2c(Cl)cc(Cl)cc12.
What is the InChIKey of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide?
The InChIKey is ILPHZQVCIBKIMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2N3O2/c1-2-15-10(18)5-19-12-8-3-7(13)4-9(14)11(8)16-6-17-12/h3-4,6H,2,5H2,1H3,(H,15,18).
What are the key properties of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide?
2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide has a molecular weight of 300.14 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide is sourced from PubChem (CID 2415100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).