4-chloro-5,7-dimethoxy-2-methylquinoline

C12H12ClNO2 — CID 43668663

IUPAC4-chloro-5,7-dimethoxy-2-methylquinoline
SMILESCOc1cc(OC)c2c(Cl)cc(C)nc2c1
InChIInChI=1S/C12H12ClNO2/c1-7-4-9(13)12-10(14-7)5-8(15-2)6-11(12)16-3/h4-6H,1-3H3
InChIKeyIDJATPZJWJQXHE-UHFFFAOYSA-N
MW237.69 g/mol
LogP3.21
Rot. Bonds2

About 4-chloro-5,7-dimethoxy-2-methylquinoline

4-chloro-5,7-dimethoxy-2-methylquinoline (PubChem CID 43668663) has the molecular formula C12H12ClNO2 and a molecular weight of 237.69 g/mol. Its IUPAC name is 4-chloro-5,7-dimethoxy-2-methylquinoline.

Molecular Properties

Compound Name4-chloro-5,7-dimethoxy-2-methylquinoline
PubChem CID43668663
Molecular FormulaC12H12ClNO2
Molecular Weight237.69 g/mol
Exact Mass237.06
IUPAC Name4-chloro-5,7-dimethoxy-2-methylquinoline
SMILESCOc1cc(OC)c2c(Cl)cc(C)nc2c1
InChIInChI=1S/C12H12ClNO2/c1-7-4-9(13)12-10(14-7)5-8(15-2)6-11(12)16-3/h4-6H,1-3H3
InChIKeyIDJATPZJWJQXHE-UHFFFAOYSA-N
XLogP3.21
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-5,7-dimethoxy-2-phenylquinoline
CID 43668662
5-bromo-4-chloro-6-methoxy-2-methylquinoline
CID 82581093
4-chloro-6,7-dimethoxy-2-methylquinoline
CID 39732475
5,7-dimethoxy-2-methylquinazolin-4-amine
CID 121232340
2-chloro-5,7-dimethoxy-4-methylquinoline-3-carbaldehyde
CID 84640028
2,4-dichloro-5-fluoro-7-methoxyquinoline
CID 169256854
4-chloro-6-methyl-2-(2,4,6-trimethoxyphenyl)pyrimidine
CID 43557849
3-ethyl-5,7-dimethoxy-2-methylquinolin-4-amine
CID 62203590
4-chloro-5,7-dimethoxy-2-(3-methylthiophen-2-yl)quinazoline
CID 114591327
1,3,6,8-tetramethoxyacridine
CID 175793272
2-(2,3-dichlorophenyl)-4-methoxy-6-methylpyridine
CID 118813607
4-chloro-6,8-dimethoxy-2-methylquinazoline
CID 89399960

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5,7-dimethoxy-2-methylquinoline?
The IUPAC name of 4-chloro-5,7-dimethoxy-2-methylquinoline (CID 43668663) is 4-chloro-5,7-dimethoxy-2-methylquinoline.
What is the SMILES notation for 4-chloro-5,7-dimethoxy-2-methylquinoline?
The canonical SMILES for 4-chloro-5,7-dimethoxy-2-methylquinoline is COc1cc(OC)c2c(Cl)cc(C)nc2c1.
What is the InChIKey of 4-chloro-5,7-dimethoxy-2-methylquinoline?
The InChIKey is IDJATPZJWJQXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClNO2/c1-7-4-9(13)12-10(14-7)5-8(15-2)6-11(12)16-3/h4-6H,1-3H3.
What are the key properties of 4-chloro-5,7-dimethoxy-2-methylquinoline?
4-chloro-5,7-dimethoxy-2-methylquinoline has a molecular weight of 237.69 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5,7-dimethoxy-2-methylquinoline is sourced from PubChem (CID 43668663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).