8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one

C10H7BrFNO3 — CID 169256273

IUPAC8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one
SMILESCOc1c(F)cc(Br)c2[nH]c(=O)cc(O)c12
InChIInChI=1S/C10H7BrFNO3/c1-16-10-5(12)2-4(11)9-8(10)6(14)3-7(15)13-9/h2-3H,1H3,(H2,13,14,15)
InChIKeyQBBVITWXMFHLRF-UHFFFAOYSA-N
MW288.07 g/mol
LogP2.14
Rot. Bonds1

About 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one

8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one (PubChem CID 169256273) has the molecular formula C10H7BrFNO3 and a molecular weight of 288.07 g/mol. Its IUPAC name is 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one.

Molecular Properties

Compound Name8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one
PubChem CID169256273
Molecular FormulaC10H7BrFNO3
Molecular Weight288.07 g/mol
Exact Mass286.96
IUPAC Name8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one
SMILESCOc1c(F)cc(Br)c2[nH]c(=O)cc(O)c12
InChIInChI=1S/C10H7BrFNO3/c1-16-10-5(12)2-4(11)9-8(10)6(14)3-7(15)13-9/h2-3H,1H3,(H2,13,14,15)
InChIKeyQBBVITWXMFHLRF-UHFFFAOYSA-N
XLogP2.14
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.07
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-fluoro-4-hydroxy-6-methyl-1H-quinolin-2-one
CID 164656982
7-chloro-4-hydroxy-8-methoxy-1H-quinolin-2-one
CID 54705825
4-bromo-5-fluoro-2-methoxyphenol;formaldehyde
CID 174569223
7-bromo-5-fluoro-4-methoxy-2,3-dihydroinden-1-one
CID 138109935
6,8-dibromo-2-(difluoromethyl)-5-methoxy-1H-quinolin-4-one
CID 103416536
1-bromo-2,5-difluoro-4-methoxy-3-nitrobenzene
CID 170434827
methyl 6-bromo-2,4-difluoro-3-methoxybenzoate
CID 118189517
6-amino-4-bromo-2-fluoro-3-methoxyphenol
CID 84797950
5-bromo-1,3-difluoro-2-methoxybenzene
CID 2773287
methyl 2-(2-bromo-6-fluoro-4-hydroxy-3-methoxyphenyl)-2-hydroxyacetate
CID 117493779
N-(2,4-dibromo-6-fluoro-3-methoxyphenyl)acetamide
CID 86654326
4-hydroxy-5-methoxy-1H-quinolin-2-one
CID 54718133

Frequently Asked Questions

What is the IUPAC name of 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one?
The IUPAC name of 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one (CID 169256273) is 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one.
What is the SMILES notation for 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one?
The canonical SMILES for 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one is COc1c(F)cc(Br)c2[nH]c(=O)cc(O)c12.
What is the InChIKey of 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one?
The InChIKey is QBBVITWXMFHLRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrFNO3/c1-16-10-5(12)2-4(11)9-8(10)6(14)3-7(15)13-9/h2-3H,1H3,(H2,13,14,15).
What are the key properties of 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one?
8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one has a molecular weight of 288.07 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-6-fluoro-4-hydroxy-5-methoxy-1H-quinolin-2-one is sourced from PubChem (CID 169256273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).