10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine

C38H25FN2O — CID 176669028

IUPAC10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
SMILESCc1ccc(N2c3ccccc3Oc3ccccc32)c2nc(-c3ccc(F)cc3)cc(-c3cccc4ccccc34)c12
InChIInChI=1S/C38H25FN2O/c1-24-17-22-34(41-32-13-4-6-15-35(32)42-36-16-7-5-14-33(36)41)38-37(24)30(23-31(40-38)26-18-20-27(39)21-19-26)29-12-8-10-25-9-2-3-11-28(25)29/h2-23H,1H3
InChIKeyHXGZXUUDXIXBLL-UHFFFAOYSA-N
MW544.63 g/mol
LogP10.75
Rot. Bonds3

About 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine

10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine (PubChem CID 176669028) has the molecular formula C38H25FN2O and a molecular weight of 544.63 g/mol. Its IUPAC name is 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine.

Molecular Properties

Compound Name10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
PubChem CID176669028
Molecular FormulaC38H25FN2O
Molecular Weight544.63 g/mol
Exact Mass544.20
IUPAC Name10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
SMILESCc1ccc(N2c3ccccc3Oc3ccccc32)c2nc(-c3ccc(F)cc3)cc(-c3cccc4ccccc34)c12
InChIInChI=1S/C38H25FN2O/c1-24-17-22-34(41-32-13-4-6-15-35(32)42-36-16-7-5-14-33(36)41)38-37(24)30(23-31(40-38)26-18-20-27(39)21-19-26)29-12-8-10-25-9-2-3-11-28(25)29/h2-23H,1H3
InChIKeyHXGZXUUDXIXBLL-UHFFFAOYSA-N
XLogP10.75
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500544.63
LogP ≤ 510.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

10-[2-(4-chlorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine
CID 176668733
ethyl 4-[5-methyl-4-naphthalen-1-yl-8-(10-phenylphenazin-5-yl)quinolin-2-yl]benzoate
CID 176668908
10-[2-(4-fluorophenyl)-4-(4-methoxyphenyl)-5-methylquinolin-8-yl]phenothiazine
CID 176668897
5-[2-(4-fluorophenyl)-5-methyl-4-thiophen-2-ylquinolin-8-yl]-10-phenylphenazine
CID 176668683
methyl 4-[4-(4-tert-butylphenyl)-5-methyl-8-phenoxazin-10-ylquinolin-2-yl]benzoate
CID 176668849
10-[9-(3,4-dimethylphenyl)-10-naphthalen-1-yl-6-phenoxazin-10-ylanthracen-2-yl]phenoxazine
CID 59220321
10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenothiazine
CID 176669074
5-[4-naphthalen-1-yl-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]-10-phenylphenazine
CID 176668846
10-[9-(9,9-dimethylfluoren-2-yl)-10-(2-naphthalen-1-ylphenyl)-6-phenoxazin-10-ylanthracen-2-yl]phenoxazine
CID 59219822
5-[4-(3,5-dimethoxyphenyl)-2-(4-fluorophenyl)quinolin-8-yl]-10-phenylphenazine
CID 176668899
10-[5-methyl-4-phenyl-2-[4-(trifluoromethyl)phenyl]quinolin-8-yl]phenothiazine
CID 176668748
4-[4-naphthalen-1-yl-8-(10-phenylphenazin-5-yl)quinolin-2-yl]benzoic acid
CID 176669029

Frequently Asked Questions

What is the IUPAC name of 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The IUPAC name of 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine (CID 176669028) is 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine.
What is the SMILES notation for 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The canonical SMILES for 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine is Cc1ccc(N2c3ccccc3Oc3ccccc32)c2nc(-c3ccc(F)cc3)cc(-c3cccc4ccccc34)c12.
What is the InChIKey of 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
The InChIKey is HXGZXUUDXIXBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25FN2O/c1-24-17-22-34(41-32-13-4-6-15-35(32)42-36-16-7-5-14-33(36)41)38-37(24)30(23-31(40-38)26-18-20-27(39)21-19-26)29-12-8-10-25-9-2-3-11-28(25)29/h2-23H,1H3.
What are the key properties of 10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine?
10-[2-(4-fluorophenyl)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine has a molecular weight of 544.63 g/mol, XLogP of 10.75, 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)-5-methyl-4-naphthalen-1-ylquinolin-8-yl]phenoxazine is sourced from PubChem (CID 176669028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).