6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine

C14H17FN2O — CID 113399809

IUPAC6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine
SMILESCCOc1cc2c(N)c(CC)c(C)nc2cc1F
InChIInChI=1S/C14H17FN2O/c1-4-9-8(3)17-12-7-11(15)13(18-5-2)6-10(12)14(9)16/h6-7H,4-5H2,1-3H3,(H2,16,17)
InChIKeyBWUIWOHIHBPVIE-UHFFFAOYSA-N
MW248.30 g/mol
LogP3.23
Rot. Bonds3

About 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine

6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine (PubChem CID 113399809) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine.

Molecular Properties

Compound Name6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine
PubChem CID113399809
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine
SMILESCCOc1cc2c(N)c(CC)c(C)nc2cc1F
InChIInChI=1S/C14H17FN2O/c1-4-9-8(3)17-12-7-11(15)13(18-5-2)6-10(12)14(9)16/h6-7H,4-5H2,1-3H3,(H2,16,17)
InChIKeyBWUIWOHIHBPVIE-UHFFFAOYSA-N
XLogP3.23
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(6,7-diethoxy-3-ethyl-2-methylquinolin-4-yl)hydrazine
CID 62251130
1,4-diethoxy-2,5-difluorobenzene
CID 58718970
7-fluoro-6-methoxy-2-methyl-3-propan-2-ylquinolin-4-amine
CID 113363415
3-ethyl-2-methyl-6-propoxyquinolin-4-amine
CID 62329382
6-N,6-N,3-triethyl-2-methylquinoline-4,6-diamine
CID 63180558
6-chloro-3-ethyl-8-fluoro-2-methylquinolin-4-amine
CID 62203950
4-chloro-3-ethyl-7-fluoro-2,6-dimethylquinoline
CID 103996076
3,4-dibromo-6-ethoxy-7-fluoroquinoline
CID 114764166
4-bromo-6-ethoxy-7-fluoroquinoline
CID 114764168
6-ethoxy-7-fluoro-3H-quinazolin-4-one
CID 136677481
1-ethoxy-2,5-difluoro-4-methylbenzene
CID 58718803
4-ethoxy-5-ethyl-6-methylpyrimidin-2-amine
CID 13300943

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine?
The IUPAC name of 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine (CID 113399809) is 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine.
What is the SMILES notation for 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine?
The canonical SMILES for 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine is CCOc1cc2c(N)c(CC)c(C)nc2cc1F.
What is the InChIKey of 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine?
The InChIKey is BWUIWOHIHBPVIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c1-4-9-8(3)17-12-7-11(15)13(18-5-2)6-10(12)14(9)16/h6-7H,4-5H2,1-3H3,(H2,16,17).
What are the key properties of 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine?
6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine has a molecular weight of 248.30 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-3-ethyl-7-fluoro-2-methylquinolin-4-amine is sourced from PubChem (CID 113399809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).