6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole

C19H20FN3O — CID 118292944

IUPAC6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole
SMILESCN1CCC(Oc2ccc(-c3c[nH]c4cc(F)ccc34)cn2)CC1
InChIInChI=1S/C19H20FN3O/c1-23-8-6-15(7-9-23)24-19-5-2-13(11-22-19)17-12-21-18-10-14(20)3-4-16(17)18/h2-5,10-12,15,21H,6-9H2,1H3
InChIKeyVVAPACGFKVEPCQ-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.84
Rot. Bonds3

About 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole

6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole (PubChem CID 118292944) has the molecular formula C19H20FN3O and a molecular weight of 325.39 g/mol. Its IUPAC name is 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole.

Molecular Properties

Compound Name6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole
PubChem CID118292944
Molecular FormulaC19H20FN3O
Molecular Weight325.39 g/mol
Exact Mass325.16
IUPAC Name6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole
SMILESCN1CCC(Oc2ccc(-c3c[nH]c4cc(F)ccc34)cn2)CC1
InChIInChI=1S/C19H20FN3O/c1-23-8-6-15(7-9-23)24-19-5-2-13(11-22-19)17-12-21-18-10-14(20)3-4-16(17)18/h2-5,10-12,15,21H,6-9H2,1H3
InChIKeyVVAPACGFKVEPCQ-UHFFFAOYSA-N
XLogP3.84
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole?
The IUPAC name of 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole (CID 118292944) is 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole.
What is the SMILES notation for 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole?
The canonical SMILES for 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole is CN1CCC(Oc2ccc(-c3c[nH]c4cc(F)ccc34)cn2)CC1.
What is the InChIKey of 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole?
The InChIKey is VVAPACGFKVEPCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O/c1-23-8-6-15(7-9-23)24-19-5-2-13(11-22-19)17-12-21-18-10-14(20)3-4-16(17)18/h2-5,10-12,15,21H,6-9H2,1H3.
What are the key properties of 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole?
6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole has a molecular weight of 325.39 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]-1H-indole is sourced from PubChem (CID 118292944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).