3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine

C13H15FN2 — CID 63232558

IUPAC3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine
SMILESCCc1cc2ccc(F)c(C)c2nc1NC
InChIInChI=1S/C13H15FN2/c1-4-9-7-10-5-6-11(14)8(2)12(10)16-13(9)15-3/h5-7H,4H2,1-3H3,(H,15,16)
InChIKeySUAYIXCKHSPGDD-UHFFFAOYSA-N
MW218.27 g/mol
LogP3.29
Rot. Bonds2

About 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine

3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine (PubChem CID 63232558) has the molecular formula C13H15FN2 and a molecular weight of 218.27 g/mol. Its IUPAC name is 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine.

Molecular Properties

Compound Name3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine
PubChem CID63232558
Molecular FormulaC13H15FN2
Molecular Weight218.27 g/mol
Exact Mass218.12
IUPAC Name3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine
SMILESCCc1cc2ccc(F)c(C)c2nc1NC
InChIInChI=1S/C13H15FN2/c1-4-9-7-10-5-6-11(14)8(2)12(10)16-13(9)15-3/h5-7H,4H2,1-3H3,(H,15,16)
InChIKeySUAYIXCKHSPGDD-UHFFFAOYSA-N
XLogP3.29
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.27
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,8-diethyl-N-methylquinolin-2-amine
CID 63232457
3-ethyl-5,8-difluoro-N,6-dimethylquinolin-2-amine
CID 103587513
2-chloro-7-fluoro-8-methyl-3-propylquinoline
CID 63530367
3-ethyl-5,6,7-trifluoro-N-methylquinolin-2-amine
CID 63232484
(3-ethyl-8-fluoro-5-methylquinolin-2-yl)hydrazine
CID 63232243
(3-ethyl-5-fluoro-8-methylquinolin-2-yl)hydrazine
CID 63232655
5,7,8-trifluoro-N-methyl-3-propylquinolin-2-amine
CID 55174798
N-methyl-3,8-dipropylquinolin-2-amine
CID 55223741
5,8-diethoxy-3-ethyl-N-methylquinolin-2-amine
CID 63531557
(6-chloro-3-ethyl-8-fluoroquinolin-2-yl)hydrazine
CID 63232613
6-bromo-8-fluoro-N-methyl-3-propylquinolin-2-amine
CID 63526300
6-chloro-N,3-diethyl-8-fluoroquinolin-2-amine
CID 63530042

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine?
The IUPAC name of 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine (CID 63232558) is 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine.
What is the SMILES notation for 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine?
The canonical SMILES for 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine is CCc1cc2ccc(F)c(C)c2nc1NC.
What is the InChIKey of 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine?
The InChIKey is SUAYIXCKHSPGDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2/c1-4-9-7-10-5-6-11(14)8(2)12(10)16-13(9)15-3/h5-7H,4H2,1-3H3,(H,15,16).
What are the key properties of 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine?
3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine has a molecular weight of 218.27 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-7-fluoro-N,8-dimethylquinolin-2-amine is sourced from PubChem (CID 63232558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).