3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole

C19H17FN2 — CID 10517752

IUPAC3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole
SMILESFC1CNCC=C1c1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C19H17FN2/c20-16-12-21-11-10-14(16)18-15-8-4-5-9-17(15)22-19(18)13-6-2-1-3-7-13/h1-10,16,21-22H,11-12H2
InChIKeyNLBIKUBUKBVYFL-UHFFFAOYSA-N
MW292.36 g/mol
LogP4.16
Rot. Bonds2

About 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole

3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole (PubChem CID 10517752) has the molecular formula C19H17FN2 and a molecular weight of 292.36 g/mol. Its IUPAC name is 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole.

Molecular Properties

Compound Name3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole
PubChem CID10517752
Molecular FormulaC19H17FN2
Molecular Weight292.36 g/mol
Exact Mass292.14
IUPAC Name3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole
SMILESFC1CNCC=C1c1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C19H17FN2/c20-16-12-21-11-10-14(16)18-15-8-4-5-9-17(15)22-19(18)13-6-2-1-3-7-13/h1-10,16,21-22H,11-12H2
InChIKeyNLBIKUBUKBVYFL-UHFFFAOYSA-N
XLogP4.16
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole?
The IUPAC name of 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole (CID 10517752) is 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole.
What is the SMILES notation for 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole?
The canonical SMILES for 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole is FC1CNCC=C1c1c(-c2ccccc2)[nH]c2ccccc12.
What is the InChIKey of 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole?
The InChIKey is NLBIKUBUKBVYFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2/c20-16-12-21-11-10-14(16)18-15-8-4-5-9-17(15)22-19(18)13-6-2-1-3-7-13/h1-10,16,21-22H,11-12H2.
What are the key properties of 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole?
3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole has a molecular weight of 292.36 g/mol, XLogP of 4.16, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-1,2,3,6-tetrahydropyridin-4-yl)-2-phenyl-1H-indole is sourced from PubChem (CID 10517752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).