7-chloro-2,4,8-trimethylquinoline;ethane

C14H18ClN — CID 170974379

IUPAC7-chloro-2,4,8-trimethylquinoline;ethane
SMILESCC.Cc1cc(C)c2ccc(Cl)c(C)c2n1
InChIInChI=1S/C12H12ClN.C2H6/c1-7-6-8(2)14-12-9(3)11(13)5-4-10(7)12;1-2/h4-6H,1-3H3;1-2H3
InChIKeySKPDNXWKZRNBHQ-UHFFFAOYSA-N
MW235.76 g/mol
LogP4.84
Rot. Bonds

About 7-chloro-2,4,8-trimethylquinoline;ethane

7-chloro-2,4,8-trimethylquinoline;ethane (PubChem CID 170974379) has the molecular formula C14H18ClN and a molecular weight of 235.76 g/mol. Its IUPAC name is 7-chloro-2,4,8-trimethylquinoline;ethane.

Molecular Properties

Compound Name7-chloro-2,4,8-trimethylquinoline;ethane
PubChem CID170974379
Molecular FormulaC14H18ClN
Molecular Weight235.76 g/mol
Exact Mass235.11
IUPAC Name7-chloro-2,4,8-trimethylquinoline;ethane
SMILESCC.Cc1cc(C)c2ccc(Cl)c(C)c2n1
InChIInChI=1S/C12H12ClN.C2H6/c1-7-6-8(2)14-12-9(3)11(13)5-4-10(7)12;1-2/h4-6H,1-3H3;1-2H3
InChIKeySKPDNXWKZRNBHQ-UHFFFAOYSA-N
XLogP4.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.76
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(7-chloro-2,8-dimethylquinolin-4-yl)boronic acid
CID 75485966
2-(7-chloro-4,8-dimethylquinolin-2-yl)acetonitrile
CID 84626490
2-(7-chloro-4,8-dimethylquinolin-2-yl)-2-methylpropanoic acid
CID 84642426
1,6-dichloro-3,5-dimethylisoquinoline
CID 114517523
2,4,8-trimethyl-7-nitroquinoline
CID 71342477
2,4,7,8-tetramethyl-1,10-phenanthroline
CID 10108527
ethane;2,4,6,8-tetramethylquinolin-7-ol
CID 145015199
N-[(7-chloro-2,8-dimethylquinolin-4-yl)methyl]-2-methoxyethanamine
CID 82449491
4,7-dichloro-8-fluoro-2-methylquinoline
CID 43668400
2,7-dichloro-4,8-dimethylquinoline-3-carboxylic acid
CID 84641441
7,8-dichloro-2-methylquinoline-4-carbaldehyde
CID 82449304
4-bromo-7,8-dichloro-2-methylquinoline
CID 39346159

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2,4,8-trimethylquinoline;ethane?
The IUPAC name of 7-chloro-2,4,8-trimethylquinoline;ethane (CID 170974379) is 7-chloro-2,4,8-trimethylquinoline;ethane.
What is the SMILES notation for 7-chloro-2,4,8-trimethylquinoline;ethane?
The canonical SMILES for 7-chloro-2,4,8-trimethylquinoline;ethane is CC.Cc1cc(C)c2ccc(Cl)c(C)c2n1.
What is the InChIKey of 7-chloro-2,4,8-trimethylquinoline;ethane?
The InChIKey is SKPDNXWKZRNBHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12ClN.C2H6/c1-7-6-8(2)14-12-9(3)11(13)5-4-10(7)12;1-2/h4-6H,1-3H3;1-2H3.
What are the key properties of 7-chloro-2,4,8-trimethylquinoline;ethane?
7-chloro-2,4,8-trimethylquinoline;ethane has a molecular weight of 235.76 g/mol, XLogP of 4.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2,4,8-trimethylquinoline;ethane is sourced from PubChem (CID 170974379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).