7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole

C16H10FN3 — CID 155585000

IUPAC7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole
SMILESFc1cncc(-c2ccc3c(c2)[nH]c2ccncc23)c1
InChIInChI=1S/C16H10FN3/c17-12-5-11(7-19-8-12)10-1-2-13-14-9-18-4-3-15(14)20-16(13)6-10/h1-9,20H
InChIKeyWRWFUXLZQXIVRK-UHFFFAOYSA-N
MW263.27 g/mol
LogP3.92
Rot. Bonds1

About 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole

7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole (PubChem CID 155585000) has the molecular formula C16H10FN3 and a molecular weight of 263.27 g/mol. Its IUPAC name is 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole.

Molecular Properties

Compound Name7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole
PubChem CID155585000
Molecular FormulaC16H10FN3
Molecular Weight263.27 g/mol
Exact Mass263.09
IUPAC Name7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole
SMILESFc1cncc(-c2ccc3c(c2)[nH]c2ccncc23)c1
InChIInChI=1S/C16H10FN3/c17-12-5-11(7-19-8-12)10-1-2-13-14-9-18-4-3-15(14)20-16(13)6-10/h1-9,20H
InChIKeyWRWFUXLZQXIVRK-UHFFFAOYSA-N
XLogP3.92
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole?
The IUPAC name of 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole (CID 155585000) is 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole.
What is the SMILES notation for 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole?
The canonical SMILES for 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole is Fc1cncc(-c2ccc3c(c2)[nH]c2ccncc23)c1.
What is the InChIKey of 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole?
The InChIKey is WRWFUXLZQXIVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN3/c17-12-5-11(7-19-8-12)10-1-2-13-14-9-18-4-3-15(14)20-16(13)6-10/h1-9,20H.
What are the key properties of 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole?
7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole has a molecular weight of 263.27 g/mol, XLogP of 3.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole is sourced from PubChem (CID 155585000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).