5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole

C23H13FN2O — CID 144612653

IUPAC5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole
SMILESFc1cc(-n2c3ccccc3c3ncccc32)c2oc3ccccc3c2c1
InChIInChI=1S/C23H13FN2O/c24-14-12-17-15-6-2-4-10-21(15)27-23(17)20(13-14)26-18-8-3-1-7-16(18)22-19(26)9-5-11-25-22/h1-13H
InChIKeyNMPNNCAAUPZUSO-UHFFFAOYSA-N
MW352.37 g/mol
LogP6.22
Rot. Bonds1

About 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole

5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole (PubChem CID 144612653) has the molecular formula C23H13FN2O and a molecular weight of 352.37 g/mol. Its IUPAC name is 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole.

Molecular Properties

Compound Name5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole
PubChem CID144612653
Molecular FormulaC23H13FN2O
Molecular Weight352.37 g/mol
Exact Mass352.10
IUPAC Name5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole
SMILESFc1cc(-n2c3ccccc3c3ncccc32)c2oc3ccccc3c2c1
InChIInChI=1S/C23H13FN2O/c24-14-12-17-15-6-2-4-10-21(15)27-23(17)20(13-14)26-18-8-3-1-7-16(18)22-19(26)9-5-11-25-22/h1-13H
InChIKeyNMPNNCAAUPZUSO-UHFFFAOYSA-N
XLogP6.22
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.37
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole?
The IUPAC name of 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole (CID 144612653) is 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole.
What is the SMILES notation for 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole?
The canonical SMILES for 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole is Fc1cc(-n2c3ccccc3c3ncccc32)c2oc3ccccc3c2c1.
What is the InChIKey of 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole?
The InChIKey is NMPNNCAAUPZUSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H13FN2O/c24-14-12-17-15-6-2-4-10-21(15)27-23(17)20(13-14)26-18-8-3-1-7-16(18)22-19(26)9-5-11-25-22/h1-13H.
What are the key properties of 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole?
5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole has a molecular weight of 352.37 g/mol, XLogP of 6.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorodibenzofuran-4-yl)pyrido[3,2-b]indole is sourced from PubChem (CID 144612653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).