4-chloro-2-methyl-6-(4-methylphenoxy)quinoline

C17H14ClNO — CID 43668795

IUPAC4-chloro-2-methyl-6-(4-methylphenoxy)quinoline
SMILESCc1ccc(Oc2ccc3nc(C)cc(Cl)c3c2)cc1
InChIInChI=1S/C17H14ClNO/c1-11-3-5-13(6-4-11)20-14-7-8-17-15(10-14)16(18)9-12(2)19-17/h3-10H,1-2H3
InChIKeyVVVFLXSWEINYFO-UHFFFAOYSA-N
MW283.76 g/mol
LogP5.30
Rot. Bonds2

About 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline

4-chloro-2-methyl-6-(4-methylphenoxy)quinoline (PubChem CID 43668795) has the molecular formula C17H14ClNO and a molecular weight of 283.76 g/mol. Its IUPAC name is 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline.

Molecular Properties

Compound Name4-chloro-2-methyl-6-(4-methylphenoxy)quinoline
PubChem CID43668795
Molecular FormulaC17H14ClNO
Molecular Weight283.76 g/mol
Exact Mass283.08
IUPAC Name4-chloro-2-methyl-6-(4-methylphenoxy)quinoline
SMILESCc1ccc(Oc2ccc3nc(C)cc(Cl)c3c2)cc1
InChIInChI=1S/C17H14ClNO/c1-11-3-5-13(6-4-11)20-14-7-8-17-15(10-14)16(18)9-12(2)19-17/h3-10H,1-2H3
InChIKeyVVVFLXSWEINYFO-UHFFFAOYSA-N
XLogP5.30
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.76
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-6-(4-methylphenoxy)quinolin-4-amine
CID 62197727
4-chloro-2-methyl-6-propan-2-yloxyquinoline
CID 22693554
3-bromo-4-chloro-6-(4-methylphenoxy)quinoline
CID 114759872
6-(4-carboxy-2-methylquinolin-6-yl)oxy-2-methylquinoline-4-carboxylic acid
CID 4639551
6-methoxy-2-methyl-4-(4-methylphenyl)quinoline
CID 101221850
4,6,7-trichloro-2-methylquinoline
CID 17039821
4-chloro-2-cyclopropyl-6-phenoxyquinoline
CID 63408910
4-bromo-6-(4-chlorophenoxy)-2-methylquinazoline
CID 106584473
4-(3,4-dimethylphenoxy)-2,6-dimethylquinoline
CID 23962836
4-chloro-6-phenoxyquinoline
CID 43531961
3-[3,5-dichloro-4-(2,4-dimethylquinolin-6-yl)oxyphenyl]propanoic acid
CID 68528032
[6-(2-chlorophenoxy)-2-methylquinolin-4-yl]hydrazine
CID 63483697

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline?
The IUPAC name of 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline (CID 43668795) is 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline.
What is the SMILES notation for 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline?
The canonical SMILES for 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline is Cc1ccc(Oc2ccc3nc(C)cc(Cl)c3c2)cc1.
What is the InChIKey of 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline?
The InChIKey is VVVFLXSWEINYFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClNO/c1-11-3-5-13(6-4-11)20-14-7-8-17-15(10-14)16(18)9-12(2)19-17/h3-10H,1-2H3.
What are the key properties of 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline?
4-chloro-2-methyl-6-(4-methylphenoxy)quinoline has a molecular weight of 283.76 g/mol, XLogP of 5.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methyl-6-(4-methylphenoxy)quinoline is sourced from PubChem (CID 43668795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).