4-chloro-2-ethyl-5,6,7-trimethoxyquinoline

C14H16ClNO3 — CID 43668765

IUPAC4-chloro-2-ethyl-5,6,7-trimethoxyquinoline
SMILESCCc1cc(Cl)c2c(OC)c(OC)c(OC)cc2n1
InChIInChI=1S/C14H16ClNO3/c1-5-8-6-9(15)12-10(16-8)7-11(17-2)13(18-3)14(12)19-4/h6-7H,5H2,1-4H3
InChIKeyGCAZFYUEUGCXTO-UHFFFAOYSA-N
MW281.74 g/mol
LogP3.48
Rot. Bonds4

About 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline

4-chloro-2-ethyl-5,6,7-trimethoxyquinoline (PubChem CID 43668765) has the molecular formula C14H16ClNO3 and a molecular weight of 281.74 g/mol. Its IUPAC name is 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline.

Molecular Properties

Compound Name4-chloro-2-ethyl-5,6,7-trimethoxyquinoline
PubChem CID43668765
Molecular FormulaC14H16ClNO3
Molecular Weight281.74 g/mol
Exact Mass281.08
IUPAC Name4-chloro-2-ethyl-5,6,7-trimethoxyquinoline
SMILESCCc1cc(Cl)c2c(OC)c(OC)c(OC)cc2n1
InChIInChI=1S/C14H16ClNO3/c1-5-8-6-9(15)12-10(16-8)7-11(17-2)13(18-3)14(12)19-4/h6-7H,5H2,1-4H3
InChIKeyGCAZFYUEUGCXTO-UHFFFAOYSA-N
XLogP3.48
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.74
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-2-ethyl-6,7-dimethoxyquinoline
CID 43668679
4-chloro-2-ethyl-5,6,7-trimethoxy-3-methylquinoline
CID 63561861
4-chloro-2-ethyl-6,8-dimethoxyquinoline
CID 43668808
4-chloro-6,7-dimethoxy-2-propylquinoline
CID 43668677
2,9-diethyl-4,7-dimethoxy-1,10-phenanthroline
CID 102487676
N,2-diethyl-6,7-dimethoxyquinolin-4-amine
CID 55045702
2-(ethylamino)-5,6,7-trimethoxy-3H-quinazolin-4-one
CID 136743156
5,7-dichloro-2-ethyl-N-propylquinolin-4-amine
CID 63479712
2-(chloromethyl)-4-methoxyquinoline
CID 63375679
2,4-dichloro-6,7-dimethoxy-5-phenylquinazoline
CID 22707020
6-chloro-N-ethyl-7-methoxy-2-(2-methylpropyl)quinolin-4-amine
CID 107623093
2-(3-chlorophenyl)-5,6,7-trimethoxyquinoline-4-carboxylic acid
CID 18073587

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline?
The IUPAC name of 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline (CID 43668765) is 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline.
What is the SMILES notation for 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline?
The canonical SMILES for 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline is CCc1cc(Cl)c2c(OC)c(OC)c(OC)cc2n1.
What is the InChIKey of 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline?
The InChIKey is GCAZFYUEUGCXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClNO3/c1-5-8-6-9(15)12-10(16-8)7-11(17-2)13(18-3)14(12)19-4/h6-7H,5H2,1-4H3.
What are the key properties of 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline?
4-chloro-2-ethyl-5,6,7-trimethoxyquinoline has a molecular weight of 281.74 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethyl-5,6,7-trimethoxyquinoline is sourced from PubChem (CID 43668765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).