ethane;2-ethoxy-4-methylquinoline

C16H25NO — CID 142037221

IUPACethane;2-ethoxy-4-methylquinoline
SMILESCC.CC.CCOc1cc(C)c2ccccc2n1
InChIInChI=1S/C12H13NO.2C2H6/c1-3-14-12-8-9(2)10-6-4-5-7-11(10)13-12;2*1-2/h4-8H,3H2,1-2H3;2*1-2H3
InChIKeyYQRQCZGCASCUBE-UHFFFAOYSA-N
MW247.38 g/mol
LogP4.99
Rot. Bonds2

About ethane;2-ethoxy-4-methylquinoline

ethane;2-ethoxy-4-methylquinoline (PubChem CID 142037221) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is ethane;2-ethoxy-4-methylquinoline.

Molecular Properties

Compound Nameethane;2-ethoxy-4-methylquinoline
PubChem CID142037221
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Nameethane;2-ethoxy-4-methylquinoline
SMILESCC.CC.CCOc1cc(C)c2ccccc2n1
InChIInChI=1S/C12H13NO.2C2H6/c1-3-14-12-8-9(2)10-6-4-5-7-11(10)13-12;2*1-2/h4-8H,3H2,1-2H3;2*1-2H3
InChIKeyYQRQCZGCASCUBE-UHFFFAOYSA-N
XLogP4.99
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

O-(4-methylquinolin-2-yl)hydroxylamine
CID 121366650
2-ethoxy-8-methoxy-4-methylquinoline
CID 70328444
2-ethoxy-4-methyl-8-methylsulfanylquinoline
CID 143158319
5-[(4-methylquinolin-2-yl)oxymethyl]-3H-1,3,4-thiadiazole-2-thione
CID 15871921
2-(4-ethoxy-3,5-dimethylphenyl)-3H-quinazolin-4-one
CID 168551010
2-ethoxy-4-methylquinazoline
CID 119090312
2-(2-bromoethyl)-4-methylquinoline
CID 174495711
5-tert-butyl-2-ethoxyquinoline
CID 174825204
N-(2-ethoxyquinolin-4-yl)morpholin-4-amine
CID 173143480
6-ethoxy-3-(methoxymethoxy)-2,4-dimethylpyridine
CID 91192685
2-bromo-4-ethoxyquinoline
CID 824618
2-methoxy-1-(4-methylquinolin-2-yl)ethanone
CID 114754716

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethoxy-4-methylquinoline?
The IUPAC name of ethane;2-ethoxy-4-methylquinoline (CID 142037221) is ethane;2-ethoxy-4-methylquinoline.
What is the SMILES notation for ethane;2-ethoxy-4-methylquinoline?
The canonical SMILES for ethane;2-ethoxy-4-methylquinoline is CC.CC.CCOc1cc(C)c2ccccc2n1.
What is the InChIKey of ethane;2-ethoxy-4-methylquinoline?
The InChIKey is YQRQCZGCASCUBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO.2C2H6/c1-3-14-12-8-9(2)10-6-4-5-7-11(10)13-12;2*1-2/h4-8H,3H2,1-2H3;2*1-2H3.
What are the key properties of ethane;2-ethoxy-4-methylquinoline?
ethane;2-ethoxy-4-methylquinoline has a molecular weight of 247.38 g/mol, XLogP of 4.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethoxy-4-methylquinoline is sourced from PubChem (CID 142037221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).