4-chloro-6-methylquinoline;hydrobromide

C10H9BrClN — CID 163342564

IUPAC4-chloro-6-methylquinoline;hydrobromide
SMILESBr.Cc1ccc2nccc(Cl)c2c1
InChIInChI=1S/C10H8ClN.BrH/c1-7-2-3-10-8(6-7)9(11)4-5-12-10;/h2-6H,1H3;1H
InChIKeyVFEKXVCTPJVTAW-UHFFFAOYSA-N
MW258.55 g/mol
LogP3.77
Rot. Bonds

About 4-chloro-6-methylquinoline;hydrobromide

4-chloro-6-methylquinoline;hydrobromide (PubChem CID 163342564) has the molecular formula C10H9BrClN and a molecular weight of 258.55 g/mol. Its IUPAC name is 4-chloro-6-methylquinoline;hydrobromide.

Molecular Properties

Compound Name4-chloro-6-methylquinoline;hydrobromide
PubChem CID163342564
Molecular FormulaC10H9BrClN
Molecular Weight258.55 g/mol
Exact Mass256.96
IUPAC Name4-chloro-6-methylquinoline;hydrobromide
SMILESBr.Cc1ccc2nccc(Cl)c2c1
InChIInChI=1S/C10H8ClN.BrH/c1-7-2-3-10-8(6-7)9(11)4-5-12-10;/h2-6H,1H3;1H
InChIKeyVFEKXVCTPJVTAW-UHFFFAOYSA-N
XLogP3.77
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.55
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-N-methylquinolin-6-amine
CID 157043807
4-chloroquinoline-6-carbaldehyde
CID 53417226
4-chloroquinoline;ethane
CID 91461667
4-chloro-7-methyl-1,6-naphthyridine
CID 69177238
6-methyl-4-phenylquinoline
CID 15512349
4-chloro-6-phenoxyquinoline
CID 43531961
4-(azepan-1-yl)-6-methylquinoline
CID 133466822
N,N'-bis(6-methylquinolin-4-yl)heptane-1,7-diamine
CID 118717458
6-methylquinoline-4-carboximidamide
CID 83677821
2-(6-methylquinolin-4-yl)oxyethanol
CID 50877423
4,7-dichloroquinoline
CID 6866
N-[(4-chloroquinolin-6-yl)-methyl-oxo-λ6-sulfanylidene]acetamide
CID 87609584

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methylquinoline;hydrobromide?
The IUPAC name of 4-chloro-6-methylquinoline;hydrobromide (CID 163342564) is 4-chloro-6-methylquinoline;hydrobromide.
What is the SMILES notation for 4-chloro-6-methylquinoline;hydrobromide?
The canonical SMILES for 4-chloro-6-methylquinoline;hydrobromide is Br.Cc1ccc2nccc(Cl)c2c1.
What is the InChIKey of 4-chloro-6-methylquinoline;hydrobromide?
The InChIKey is VFEKXVCTPJVTAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN.BrH/c1-7-2-3-10-8(6-7)9(11)4-5-12-10;/h2-6H,1H3;1H.
What are the key properties of 4-chloro-6-methylquinoline;hydrobromide?
4-chloro-6-methylquinoline;hydrobromide has a molecular weight of 258.55 g/mol, XLogP of 3.77, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-methylquinoline;hydrobromide is sourced from PubChem (CID 163342564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).