8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine

C18H17FN2 — CID 104847019

IUPAC8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine
SMILESCNc1c(C)c(-c2ccccc2)nc2c(F)cc(C)cc12
InChIInChI=1S/C18H17FN2/c1-11-9-14-17(20-3)12(2)16(13-7-5-4-6-8-13)21-18(14)15(19)10-11/h4-10H,1-3H3,(H,20,21)
InChIKeySTZAFURPVLITGH-UHFFFAOYSA-N
MW280.35 g/mol
LogP4.70
Rot. Bonds2

About 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine

8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine (PubChem CID 104847019) has the molecular formula C18H17FN2 and a molecular weight of 280.35 g/mol. Its IUPAC name is 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine.

Molecular Properties

Compound Name8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine
PubChem CID104847019
Molecular FormulaC18H17FN2
Molecular Weight280.35 g/mol
Exact Mass280.14
IUPAC Name8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine
SMILESCNc1c(C)c(-c2ccccc2)nc2c(F)cc(C)cc12
InChIInChI=1S/C18H17FN2/c1-11-9-14-17(20-3)12(2)16(13-7-5-4-6-8-13)21-18(14)15(19)10-11/h4-10H,1-3H3,(H,20,21)
InChIKeySTZAFURPVLITGH-UHFFFAOYSA-N
XLogP4.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,3,6,8-tetramethyl-2-phenylquinolin-4-amine
CID 104846969
(3,6,8-trimethyl-2-phenylquinolin-4-yl)hydrazine
CID 104847189
2-ethyl-8-fluoro-N,3,6-trimethylquinolin-4-amine
CID 55221787
8-fluoro-3-methyl-2-phenylquinoline-4-carboxylic acid
CID 45157374
N-ethyl-3,6-dimethyl-2-phenylquinolin-4-amine
CID 104846971
5-fluoro-3,8-dimethyl-2-phenylquinolin-4-amine
CID 104847016
4-chloro-7,8-difluoro-3-methyl-2-phenylquinoline
CID 104846013
8-fluoro-5-methoxy-3-methyl-2-phenylquinolin-4-amine
CID 104847077
5-fluoro-N-methyl-6-phenylpyridin-3-amine
CID 146930379
2,4,8-trimethyl-6-phenylphenanthridine
CID 122225138
N-(3,5-dimethylphenyl)-3,6,8-trimethyl-2-phenylquinoline-4-carboxamide
CID 19647901
3-(4-methylphenyl)-2-phenylphenanthro[9,10-b]pyrazine
CID 59090361

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine?
The IUPAC name of 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine (CID 104847019) is 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine.
What is the SMILES notation for 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine?
The canonical SMILES for 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine is CNc1c(C)c(-c2ccccc2)nc2c(F)cc(C)cc12.
What is the InChIKey of 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine?
The InChIKey is STZAFURPVLITGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2/c1-11-9-14-17(20-3)12(2)16(13-7-5-4-6-8-13)21-18(14)15(19)10-11/h4-10H,1-3H3,(H,20,21).
What are the key properties of 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine?
8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine has a molecular weight of 280.35 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-N,3,6-trimethyl-2-phenylquinolin-4-amine is sourced from PubChem (CID 104847019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).