8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline

C15H12BrNOS — CID 63457720

IUPAC8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline
SMILESCc1ccc2cccc(OCc3ccc(Br)s3)c2n1
InChIInChI=1S/C15H12BrNOS/c1-10-5-6-11-3-2-4-13(15(11)17-10)18-9-12-7-8-14(16)19-12/h2-8H,9H2,1H3
InChIKeyAPVSQVGNMLSPPB-UHFFFAOYSA-N
MW334.24 g/mol
LogP4.95
Rot. Bonds3

About 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline

8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline (PubChem CID 63457720) has the molecular formula C15H12BrNOS and a molecular weight of 334.24 g/mol. Its IUPAC name is 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline.

Molecular Properties

Compound Name8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline
PubChem CID63457720
Molecular FormulaC15H12BrNOS
Molecular Weight334.24 g/mol
Exact Mass332.98
IUPAC Name8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline
SMILESCc1ccc2cccc(OCc3ccc(Br)s3)c2n1
InChIInChI=1S/C15H12BrNOS/c1-10-5-6-11-3-2-4-13(15(11)17-10)18-9-12-7-8-14(16)19-12/h2-8H,9H2,1H3
InChIKeyAPVSQVGNMLSPPB-UHFFFAOYSA-N
XLogP4.95
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.24
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-2-[(2-methylquinolin-8-yl)oxymethyl]aniline
CID 43352151
8-[(5-bromo-2-pyridinyl)methoxy]-2-methylquinoline
CID 104809806
3-[(5-bromothiophen-2-yl)methoxy]-6-methylpyridine-2-carboxylic acid
CID 79158007
8-[(6-ethyl-2-pyridinyl)methoxy]-2-methylquinoline
CID 163741532
8-[(3,6-dichloro-2-pyridinyl)methoxy]-2-methylquinoline
CID 62886311
tris[(2-methylquinolin-8-yl)oxy]gallane
CID 59002282
2-bromo-5-(2-methylquinolin-8-yl)oxy-1,3,4-thiadiazole
CID 64623654
8-[(4-chloro-6-methylpyrimidin-2-yl)methoxy]-2-methylquinoline
CID 80656920
2-methyl-8-[[4-(trifluoromethyl)phenyl]methoxy]quinoline
CID 67980760
(2R)-1-(2-methylquinolin-8-yl)oxypropan-2-ol
CID 70983446
2-bromo-5-[(3-methyl-2-nitrophenoxy)methyl]thiophene
CID 54942329
2-bromo-5-[(2-methyl-3-nitrophenoxy)methyl]thiophene
CID 47214173

Frequently Asked Questions

What is the IUPAC name of 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline?
The IUPAC name of 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline (CID 63457720) is 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline.
What is the SMILES notation for 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline?
The canonical SMILES for 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline is Cc1ccc2cccc(OCc3ccc(Br)s3)c2n1.
What is the InChIKey of 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline?
The InChIKey is APVSQVGNMLSPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrNOS/c1-10-5-6-11-3-2-4-13(15(11)17-10)18-9-12-7-8-14(16)19-12/h2-8H,9H2,1H3.
What are the key properties of 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline?
8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline has a molecular weight of 334.24 g/mol, XLogP of 4.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(5-bromothiophen-2-yl)methoxy]-2-methylquinoline is sourced from PubChem (CID 63457720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).