10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine

C37H23FN2O — CID 176668863

IUPAC10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
SMILESFc1ccc(-c2cc(-c3cccc4ccccc34)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1
InChIInChI=1S/C37H23FN2O/c38-26-21-19-25(20-22-26)31-23-30(28-12-7-10-24-9-1-2-11-27(24)28)29-13-8-16-34(37(29)39-31)40-32-14-3-5-17-35(32)41-36-18-6-4-15-33(36)40/h1-23H
InChIKeyWKBWCZMCOUCTBV-UHFFFAOYSA-N
MW530.60 g/mol
LogP10.44
Rot. Bonds3

About 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine

10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine (PubChem CID 176668863) has the molecular formula C37H23FN2O and a molecular weight of 530.60 g/mol. Its IUPAC name is 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine.

Molecular Properties

Compound Name10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
PubChem CID176668863
Molecular FormulaC37H23FN2O
Molecular Weight530.60 g/mol
Exact Mass530.18
IUPAC Name10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
SMILESFc1ccc(-c2cc(-c3cccc4ccccc34)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1
InChIInChI=1S/C37H23FN2O/c38-26-21-19-25(20-22-26)31-23-30(28-12-7-10-24-9-1-2-11-27(24)28)29-13-8-16-34(37(29)39-31)40-32-14-3-5-17-35(32)41-36-18-6-4-15-33(36)40/h1-23H
InChIKeyWKBWCZMCOUCTBV-UHFFFAOYSA-N
XLogP10.44
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.60
LogP ≤ 510.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-Naphthyl)-4-phenyl-3-[4-(4-phenyl-2-quinolyl)phenoxy]quinoline
CID 57393411
2-(1-Naphthyl)-4-phenyl-3-[4-(4-phenyl-2-quinolyl)phenoxy]quinoline
CID 57402132
10-[4-[6,7-Difluoro-3-(4-phenoxazin-10-ylphenyl)quinoxalin-2-yl]phenyl]phenoxazine
CID 139188327
Fdqpxz
CID 145766039
1-[4-(2-Fluorophenylmethoxy)phenyl]-3-phenyl-benzo[f]quinoline
CID 129763937
2-(4-Fluorophenoxy)-3-phenylquinoxaline
CID 386968
2-Methyl-8-[[3-[(2-methylquinolin-8-yl)oxymethyl]naphthalen-2-yl]methoxy]quinoline
CID 76330866
2-[[4-(4-Fluoro-2-methoxyphenyl)piperazin-1-yl]methyl]quinoline
CID 17954942
1-(4-Fluoro-2-methoxyphenyl)-4-(8-methylquinoline-2-ylmethyl)piperazine
CID 17955113
8-Fluoro-2-methyl-4-[1-(naphthalen-2-ylmethyl)piperidin-4-yl]oxyquinoline
CID 57552269
2-[4-[2-(2,2,2-Trifluoroethoxy)phenyl]-1-piperazinylmethyl]quinoline
CID 69699662
6-Fluoro-2-[4-[2-(2,2,2-trifluoroethoxy)phenyl]-1-piperazinylmethyl]quinoline
CID 69700157

Frequently Asked Questions

What is the IUPAC name of 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The IUPAC name of 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine (CID 176668863) is 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine.
What is the SMILES notation for 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The canonical SMILES for 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine is Fc1ccc(-c2cc(-c3cccc4ccccc34)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1.
What is the InChIKey of 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The InChIKey is WKBWCZMCOUCTBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H23FN2O/c38-26-21-19-25(20-22-26)31-23-30(28-12-7-10-24-9-1-2-11-27(24)28)29-13-8-16-34(37(29)39-31)40-32-14-3-5-17-35(32)41-36-18-6-4-15-33(36)40/h1-23H.
What are the key properties of 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine has a molecular weight of 530.60 g/mol, XLogP of 10.44, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[2-(4-fluorophenyl)-4-naphthalen-1-ylquinolin-8-yl]phenoxazine is sourced from PubChem (CID 176668863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).