3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole

C23H13N5O — CID 10738230

IUPAC3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole
SMILESc1ccc(-c2nc3ncccc3cc2-c2nnc3c4ccccc4nc-3o2)cc1
InChIInChI=1S/C23H13N5O/c1-2-7-14(8-3-1)19-17(13-15-9-6-12-24-21(15)26-19)22-28-27-20-16-10-4-5-11-18(16)25-23(20)29-22/h1-13H
InChIKeyWXLHSGIERBPDKE-UHFFFAOYSA-N
MW375.39 g/mol
LogP5.00
Rot. Bonds2

About 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole

3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole (PubChem CID 10738230) has the molecular formula C23H13N5O and a molecular weight of 375.39 g/mol. Its IUPAC name is 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole.

Molecular Properties

Compound Name3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole
PubChem CID10738230
Molecular FormulaC23H13N5O
Molecular Weight375.39 g/mol
Exact Mass375.11
IUPAC Name3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole
SMILESc1ccc(-c2nc3ncccc3cc2-c2nnc3c4ccccc4nc-3o2)cc1
InChIInChI=1S/C23H13N5O/c1-2-7-14(8-3-1)19-17(13-15-9-6-12-24-21(15)26-19)22-28-27-20-16-10-4-5-11-18(16)25-23(20)29-22/h1-13H
InChIKeyWXLHSGIERBPDKE-UHFFFAOYSA-N
XLogP5.00
TPSA77.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.39
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

8-bromo-3-(2-methyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole
CID 11794828
8-chloro-3-(2-methyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole
CID 10497878
6-methyl-3-([1,3,4]oxadiazino[6,5-b]indol-3-yl)chromen-2-one
CID 139218793
2-phenyl-3-[3-(2-phenylpyrazino[2,3-b]pyrazin-3-yl)naphthalen-2-yl]pyrazino[2,3-b]pyrazine
CID 20606864
2-[4-[4-phenanthren-9-yl-6-(3-phenylquinoxalin-2-yl)-2-pyridinyl]naphthalen-1-yl]-[1,3]oxazolo[4,5-b]pyridine
CID 58480115
6-[4-[4-(4-phenylquinazolin-2-yl)phenyl]phenyl]benzo[h]quinoline
CID 152916568
1-(2-phenyl-1,8-naphthyridin-3-yl)ethanamine
CID 67984591
2,5-di(quinolin-4-yl)-1,3,4-oxadiazole
CID 143438590
16-dibenzofuran-4-yl-21,23-diazahexacyclo[18.8.0.02,7.08,13.014,19.022,27]octacosa-1(20),2,4,6,8,10,12,14(19),15,17,21,23,25,27-tetradecaene
CID 134428728
2,3-diphenyl-1,7-phenanthroline;terbium
CID 174908963
2,5-bis(4-phenanthren-9-ylnaphthalen-1-yl)-1,3,4-oxadiazole
CID 23397782
2-phenyl-5-quinolin-3-yl-1,3,4-oxadiazole
CID 142733340

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole?
The IUPAC name of 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole (CID 10738230) is 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole.
What is the SMILES notation for 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole?
The canonical SMILES for 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole is c1ccc(-c2nc3ncccc3cc2-c2nnc3c4ccccc4nc-3o2)cc1.
What is the InChIKey of 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole?
The InChIKey is WXLHSGIERBPDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H13N5O/c1-2-7-14(8-3-1)19-17(13-15-9-6-12-24-21(15)26-19)22-28-27-20-16-10-4-5-11-18(16)25-23(20)29-22/h1-13H.
What are the key properties of 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole?
3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole has a molecular weight of 375.39 g/mol, XLogP of 5.00, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenyl-1,8-naphthyridin-3-yl)-[1,3,4]oxadiazino[6,5-b]indole is sourced from PubChem (CID 10738230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).