7-bromo-2-methoxy-4-methylquinoline

C11H10BrNO — CID 14570305

IUPAC7-bromo-2-methoxy-4-methylquinoline
SMILESCOc1cc(C)c2ccc(Br)cc2n1
InChIInChI=1S/C11H10BrNO/c1-7-5-11(14-2)13-10-6-8(12)3-4-9(7)10/h3-6H,1-2H3
InChIKeyCIGLFVWFRKNNSC-UHFFFAOYSA-N
MW252.11 g/mol
LogP3.31
Rot. Bonds1

About 7-bromo-2-methoxy-4-methylquinoline

7-bromo-2-methoxy-4-methylquinoline (PubChem CID 14570305) has the molecular formula C11H10BrNO and a molecular weight of 252.11 g/mol. Its IUPAC name is 7-bromo-2-methoxy-4-methylquinoline.

Molecular Properties

Compound Name7-bromo-2-methoxy-4-methylquinoline
PubChem CID14570305
Molecular FormulaC11H10BrNO
Molecular Weight252.11 g/mol
Exact Mass250.99
IUPAC Name7-bromo-2-methoxy-4-methylquinoline
SMILESCOc1cc(C)c2ccc(Br)cc2n1
InChIInChI=1S/C11H10BrNO/c1-7-5-11(14-2)13-10-6-8(12)3-4-9(7)10/h3-6H,1-2H3
InChIKeyCIGLFVWFRKNNSC-UHFFFAOYSA-N
XLogP3.31
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.11
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-bromo-2-chloro-4-methylquinoline
CID 14570303
7-bromo-4-methoxy-2-methylquinoline
CID 82581190
7-bromo-2-chloro-4-methoxyquinoline
CID 86036464
2,4-dimethoxy-7-methylquinoline
CID 70166740
2,4,7-tribromoquinoline
CID 90123951
7-bromo-2-methoxy-5-methylquinolin-6-amine
CID 167472630
7-methoxy-4-methylquinolin-2-amine
CID 53485904
7-methoxy-5-methyl-1,8-naphthyridin-2-amine
CID 14751713
7-bromo-4-chloro-2-methylquinoline
CID 17040020
dimethyl 7-bromoquinoline-2,4-dicarboxylate
CID 67245888
4,7-dichloro-2-methoxyquinoline
CID 21101818
2-bromo-6-methoxy-4-methylpyridin-3-amine
CID 19960055

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-methoxy-4-methylquinoline?
The IUPAC name of 7-bromo-2-methoxy-4-methylquinoline (CID 14570305) is 7-bromo-2-methoxy-4-methylquinoline.
What is the SMILES notation for 7-bromo-2-methoxy-4-methylquinoline?
The canonical SMILES for 7-bromo-2-methoxy-4-methylquinoline is COc1cc(C)c2ccc(Br)cc2n1.
What is the InChIKey of 7-bromo-2-methoxy-4-methylquinoline?
The InChIKey is CIGLFVWFRKNNSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrNO/c1-7-5-11(14-2)13-10-6-8(12)3-4-9(7)10/h3-6H,1-2H3.
What are the key properties of 7-bromo-2-methoxy-4-methylquinoline?
7-bromo-2-methoxy-4-methylquinoline has a molecular weight of 252.11 g/mol, XLogP of 3.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2-methoxy-4-methylquinoline is sourced from PubChem (CID 14570305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).