4-bromo-8-methyl-1,7-naphthyridine

C9H7BrN2 — CID 103416470

IUPAC4-bromo-8-methyl-1,7-naphthyridine
SMILESCc1nccc2c(Br)ccnc12
InChIInChI=1S/C9H7BrN2/c1-6-9-7(2-4-11-6)8(10)3-5-12-9/h2-5H,1H3
InChIKeyHXIUCAYMQLMLHM-UHFFFAOYSA-N
MW223.07 g/mol
LogP2.70
Rot. Bonds

About 4-bromo-8-methyl-1,7-naphthyridine

4-bromo-8-methyl-1,7-naphthyridine (PubChem CID 103416470) has the molecular formula C9H7BrN2 and a molecular weight of 223.07 g/mol. Its IUPAC name is 4-bromo-8-methyl-1,7-naphthyridine.

Molecular Properties

Compound Name4-bromo-8-methyl-1,7-naphthyridine
PubChem CID103416470
Molecular FormulaC9H7BrN2
Molecular Weight223.07 g/mol
Exact Mass221.98
IUPAC Name4-bromo-8-methyl-1,7-naphthyridine
SMILESCc1nccc2c(Br)ccnc12
InChIInChI=1S/C9H7BrN2/c1-6-9-7(2-4-11-6)8(10)3-5-12-9/h2-5H,1H3
InChIKeyHXIUCAYMQLMLHM-UHFFFAOYSA-N
XLogP2.70
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.07
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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4-bromo-8-fluoro-6-methylquinoline
CID 114764008
4-bromo-7,8-dichloroquinoline
CID 39346133
4-bromoquinoline-8-carboxylic acid
CID 71742974
4,8-dibromo-1,6-naphthyridine
CID 12520140
4-bromo-7-phenyl-1,10-phenanthroline
CID 18759599
4-bromo-2-methyl-3-(2-methylprop-1-enyl)pyridine
CID 177353845
4,5,8-tribromoquinoline
CID 114764035
2,3,4,5,6,7-hexamethyl-1,8-phenanthroline
CID 171384241
6-bromo-1-methyl-5-nitroisoquinoline
CID 154728520
5-bromo-1-chloro-8-methylisoquinoline
CID 82571489

Frequently Asked Questions

What is the IUPAC name of 4-bromo-8-methyl-1,7-naphthyridine?
The IUPAC name of 4-bromo-8-methyl-1,7-naphthyridine (CID 103416470) is 4-bromo-8-methyl-1,7-naphthyridine.
What is the SMILES notation for 4-bromo-8-methyl-1,7-naphthyridine?
The canonical SMILES for 4-bromo-8-methyl-1,7-naphthyridine is Cc1nccc2c(Br)ccnc12.
What is the InChIKey of 4-bromo-8-methyl-1,7-naphthyridine?
The InChIKey is HXIUCAYMQLMLHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN2/c1-6-9-7(2-4-11-6)8(10)3-5-12-9/h2-5H,1H3.
What are the key properties of 4-bromo-8-methyl-1,7-naphthyridine?
4-bromo-8-methyl-1,7-naphthyridine has a molecular weight of 223.07 g/mol, XLogP of 2.70, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-8-methyl-1,7-naphthyridine is sourced from PubChem (CID 103416470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).