5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile

C23H24FN3O — CID 10193950

IUPAC5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile
SMILESN#Cc1c[nH]c2ccc(CCCN3CCC(Oc4ccc(F)cc4)CC3)cc12
InChIInChI=1S/C23H24FN3O/c24-19-4-6-20(7-5-19)28-21-9-12-27(13-10-21)11-1-2-17-3-8-23-22(14-17)18(15-25)16-26-23/h3-8,14,16,21,26H,1-2,9-13H2
InChIKeyVVVQINXECOLIRC-UHFFFAOYSA-N
MW377.46 g/mol
LogP4.65
Rot. Bonds6

About 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile

5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile (PubChem CID 10193950) has the molecular formula C23H24FN3O and a molecular weight of 377.46 g/mol. Its IUPAC name is 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile.

Molecular Properties

Compound Name5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile
PubChem CID10193950
Molecular FormulaC23H24FN3O
Molecular Weight377.46 g/mol
Exact Mass377.19
IUPAC Name5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile
SMILESN#Cc1c[nH]c2ccc(CCCN3CCC(Oc4ccc(F)cc4)CC3)cc12
InChIInChI=1S/C23H24FN3O/c24-19-4-6-20(7-5-19)28-21-9-12-27(13-10-21)11-1-2-17-3-8-23-22(14-17)18(15-25)16-26-23/h3-8,14,16,21,26H,1-2,9-13H2
InChIKeyVVVQINXECOLIRC-UHFFFAOYSA-N
XLogP4.65
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.46
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile with MolForge

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

Launch Full Analysis

Related Compounds

4-[1-[3-(3-cyano-1H-indol-6-yl)propyl]piperidin-4-yl]oxybenzamide
CID 10150811
1-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]indole-3-carbonitrile
CID 69072549
5-[3-[4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]propyl]-1H-indole-3-carbonitrile
CID 10150610
3-[4-(4-fluorophenoxy)piperidin-1-yl]propan-1-ol
CID 111381858
5-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1H-indole-3-carbonitrile
CID 22017560
3-[1-[3-(4-fluorophenoxy)propyl]piperidin-4-yl]-1H-indole-5-carbonitrile
CID 10134202
5-[3-[4-([1,2]thiazolo[4,5-c]pyridin-4-yl)piperazin-1-yl]propyl]-1H-indole-3-carbonitrile
CID 67020598
3-[3-[4-[3-(5-fluoro-1H-indol-3-yl)propyl]piperazin-1-yl]propyl]-5-methoxy-1H-indole
CID 72734844
1-[3-(4-fluorophenyl)propyl]piperidin-4-ol
CID 21180751
3-[4-[4-(2-oxochromen-7-yl)oxypiperidin-1-yl]butyl]-1H-indole-5-carbonitrile
CID 11224490
4-(4-fluorophenoxy)-1-[2-(1H-imidazol-2-yl)ethyl]piperidine
CID 131950223
5-fluoro-2-[[(3R)-3-pyridin-4-yloxypyrrolidin-1-yl]methyl]benzonitrile
CID 97236443

Frequently Asked Questions

What is the IUPAC name of 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile?
The IUPAC name of 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile (CID 10193950) is 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile.
What is the SMILES notation for 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile?
The canonical SMILES for 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile is N#Cc1c[nH]c2ccc(CCCN3CCC(Oc4ccc(F)cc4)CC3)cc12.
What is the InChIKey of 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile?
The InChIKey is VVVQINXECOLIRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3O/c24-19-4-6-20(7-5-19)28-21-9-12-27(13-10-21)11-1-2-17-3-8-23-22(14-17)18(15-25)16-26-23/h3-8,14,16,21,26H,1-2,9-13H2.
What are the key properties of 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile?
5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile has a molecular weight of 377.46 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[4-(4-fluorophenoxy)piperidin-1-yl]propyl]-1H-indole-3-carbonitrile is sourced from PubChem (CID 10193950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).