2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide

C17H13Cl2N3O3 — CID 2704087

IUPAC2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ncnc3c(Cl)cc(Cl)cc23)c1
InChIInChI=1S/C17H13Cl2N3O3/c1-24-12-4-2-3-11(7-12)22-15(23)8-25-17-13-5-10(18)6-14(19)16(13)20-9-21-17/h2-7,9H,8H2,1H3,(H,22,23)
InChIKeyIVYNCUPFBSEKDJ-UHFFFAOYSA-N
MW378.22 g/mol
LogP3.96
Rot. Bonds5

About 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide

2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide (PubChem CID 2704087) has the molecular formula C17H13Cl2N3O3 and a molecular weight of 378.22 g/mol. Its IUPAC name is 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide
PubChem CID2704087
Molecular FormulaC17H13Cl2N3O3
Molecular Weight378.22 g/mol
Exact Mass377.03
IUPAC Name2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ncnc3c(Cl)cc(Cl)cc23)c1
InChIInChI=1S/C17H13Cl2N3O3/c1-24-12-4-2-3-11(7-12)22-15(23)8-25-17-13-5-10(18)6-14(19)16(13)20-9-21-17/h2-7,9H,8H2,1H3,(H,22,23)
InChIKeyIVYNCUPFBSEKDJ-UHFFFAOYSA-N
XLogP3.96
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.22
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(6,8-dichloroquinazolin-4-yl)oxy-N-naphthalen-2-ylacetamide
CID 4005082
2-(6,8-dichloroquinazolin-4-yl)oxy-N-(4-ethoxyphenyl)acetamide
CID 4310600
N-(3-methoxyphenyl)-2-thieno[2,3-d]pyrimidin-4-yloxyacetamide
CID 2705200
2-(5-chloroquinolin-8-yl)oxy-N-(3-methoxyphenyl)acetamide
CID 8716362
2-(6,8-dichloroquinazolin-4-yl)oxy-N-ethylacetamide
CID 2415100
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-[(3-chlorophenyl)methyl]-2-(6,8-dichloroquinazolin-4-yl)oxyacetamide
CID 4641621
2-(3-chloro-4-fluorophenoxy)-N-(3-methoxyphenyl)acetamide
CID 7751222
2-(2-acetyl-4-chlorophenoxy)-N-(3-methoxyphenyl)acetamide
CID 41021404
N-(3,5-dimethoxyphenyl)-2-quinazolin-4-yloxyacetamide
CID 2375476
2-(3-fluorophenoxy)-N-(3-methoxyphenyl)acetamide
CID 2709796
2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 7290642

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide (CID 2704087) is 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)COc2ncnc3c(Cl)cc(Cl)cc23)c1.
What is the InChIKey of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide?
The InChIKey is IVYNCUPFBSEKDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2N3O3/c1-24-12-4-2-3-11(7-12)22-15(23)8-25-17-13-5-10(18)6-14(19)16(13)20-9-21-17/h2-7,9H,8H2,1H3,(H,22,23).
What are the key properties of 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide?
2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide has a molecular weight of 378.22 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dichloroquinazolin-4-yl)oxy-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 2704087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).