6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one

C11H12BrNO2 — CID 66560026

IUPAC6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one
SMILESCCOc1cc2c(cc1Br)CCC(=O)N2
InChIInChI=1S/C11H12BrNO2/c1-2-15-10-6-9-7(5-8(10)12)3-4-11(14)13-9/h5-6H,2-4H2,1H3,(H,13,14)
InChIKeyFWJZBMVSCPUZDY-UHFFFAOYSA-N
MW270.13 g/mol
LogP2.73
Rot. Bonds2

About 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one

6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one (PubChem CID 66560026) has the molecular formula C11H12BrNO2 and a molecular weight of 270.13 g/mol. Its IUPAC name is 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one
PubChem CID66560026
Molecular FormulaC11H12BrNO2
Molecular Weight270.13 g/mol
Exact Mass269.01
IUPAC Name6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one
SMILESCCOc1cc2c(cc1Br)CCC(=O)N2
InChIInChI=1S/C11H12BrNO2/c1-2-15-10-6-9-7(5-8(10)12)3-4-11(14)13-9/h5-6H,2-4H2,1H3,(H,13,14)
InChIKeyFWJZBMVSCPUZDY-UHFFFAOYSA-N
XLogP2.73
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.13
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(6-ethoxy-2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetic acid
CID 46786283
4-[(6-bromo-2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxymethyl]benzoic acid
CID 59316609
6-bromo-7-cyclopentyloxy-3,4-dihydro-1H-quinolin-2-one
CID 66560028
5,6-diethoxy-1,3-dihydroindol-2-one
CID 22668692
6-bromo-7-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 43457689
6-amino-7-heptoxy-3,4-dihydro-1H-quinolin-2-one
CID 43455700
7-amino-6-(2-ethoxyethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 43382899
6-amino-7-bromo-3,4-dihydro-1H-quinolin-2-one
CID 117209588
6-amino-7-[(4-bromophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 82805294
6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one
CID 103486501
7-ethyl-6-iodo-3,4-dihydro-1H-quinolin-2-one
CID 145283835
6-amino-7-trimethylsilyloxy-3,4-dihydro-1H-quinolin-2-one
CID 167723388

Frequently Asked Questions

What is the IUPAC name of 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one (CID 66560026) is 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one is CCOc1cc2c(cc1Br)CCC(=O)N2.
What is the InChIKey of 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is FWJZBMVSCPUZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrNO2/c1-2-15-10-6-9-7(5-8(10)12)3-4-11(14)13-9/h5-6H,2-4H2,1H3,(H,13,14).
What are the key properties of 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one?
6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 270.13 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 66560026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).