2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide

C18H15BrN2O3 — CID 175975800

IUPAC2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide
SMILESCOc1cc(CC(N)=O)cc(Oc2ccnc3ccc(Br)cc23)c1
InChIInChI=1S/C18H15BrN2O3/c1-23-13-6-11(8-18(20)22)7-14(10-13)24-17-4-5-21-16-3-2-12(19)9-15(16)17/h2-7,9-10H,8H2,1H3,(H2,20,22)
InChIKeyAWQYEPIGIVFXIW-UHFFFAOYSA-N
MW387.23 g/mol
LogP3.83
Rot. Bonds5

About 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide

2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide (PubChem CID 175975800) has the molecular formula C18H15BrN2O3 and a molecular weight of 387.23 g/mol. Its IUPAC name is 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide.

Molecular Properties

Compound Name2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide
PubChem CID175975800
Molecular FormulaC18H15BrN2O3
Molecular Weight387.23 g/mol
Exact Mass386.03
IUPAC Name2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide
SMILESCOc1cc(CC(N)=O)cc(Oc2ccnc3ccc(Br)cc23)c1
InChIInChI=1S/C18H15BrN2O3/c1-23-13-6-11(8-18(20)22)7-14(10-13)24-17-4-5-21-16-3-2-12(19)9-15(16)17/h2-7,9-10H,8H2,1H3,(H2,20,22)
InChIKeyAWQYEPIGIVFXIW-UHFFFAOYSA-N
XLogP3.83
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.23
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-4-(3-methoxy-5-pyrazol-1-ylphenoxy)quinoline
CID 171763820
4-(3-acetamido-5-methoxyphenoxy)-7-methoxyquinoline-6-carboxamide
CID 166095714
7-methoxy-4-[3-methoxy-5-(methylcarbamoyl)phenoxy]quinoline-6-carboxamide
CID 171763786
1-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-5-(4-methylphenyl)pentane-2,4-dione
CID 58249515
3-methoxy-N-methyl-5-quinolin-4-yloxybenzamide
CID 171350090
2-[4-(6-carbamoyl-7-methoxyquinolin-4-yl)oxyphenyl]acetic acid
CID 67304323
2-[4-(7-methoxyquinolin-4-yl)oxyphenyl]acetic acid
CID 18456647
N-[(6-bromoquinolin-4-yl)methyl]-1-(2,4-dimethoxyphenyl)-N-methylmethanamine
CID 178046475
2-(3,4-dimethoxyphenyl)-N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]acetamide
CID 152648895
ethane;O-(6-methoxyquinolin-4-yl)hydroxylamine
CID 157043543
6-bromo-7-methoxy-4-(3-methoxy-5-pyrazol-1-ylphenoxy)quinoline
CID 171763807
methyl 3-[5-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-2,4-dioxopentyl]benzoate
CID 58249424

Frequently Asked Questions

What is the IUPAC name of 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide?
The IUPAC name of 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide (CID 175975800) is 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide.
What is the SMILES notation for 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide?
The canonical SMILES for 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide is COc1cc(CC(N)=O)cc(Oc2ccnc3ccc(Br)cc23)c1.
What is the InChIKey of 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide?
The InChIKey is AWQYEPIGIVFXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN2O3/c1-23-13-6-11(8-18(20)22)7-14(10-13)24-17-4-5-21-16-3-2-12(19)9-15(16)17/h2-7,9-10H,8H2,1H3,(H2,20,22).
What are the key properties of 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide?
2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide has a molecular weight of 387.23 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(6-bromoquinolin-4-yl)oxy-5-methoxyphenyl]acetamide is sourced from PubChem (CID 175975800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).