4-(3-fluoropiperidin-3-yl)-1H-indole

C13H15FN2 — CID 112563033

IUPAC4-(3-fluoropiperidin-3-yl)-1H-indole
SMILESFC1(c2cccc3[nH]ccc23)CCCNC1
InChIInChI=1S/C13H15FN2/c14-13(6-2-7-15-9-13)11-3-1-4-12-10(11)5-8-16-12/h1,3-5,8,15-16H,2,6-7,9H2
InChIKeyBWCDTXRQLFCZBS-UHFFFAOYSA-N
MW218.28 g/mol
LogP2.72
Rot. Bonds1

About 4-(3-fluoropiperidin-3-yl)-1H-indole

4-(3-fluoropiperidin-3-yl)-1H-indole (PubChem CID 112563033) has the molecular formula C13H15FN2 and a molecular weight of 218.28 g/mol. Its IUPAC name is 4-(3-fluoropiperidin-3-yl)-1H-indole.

Molecular Properties

Compound Name4-(3-fluoropiperidin-3-yl)-1H-indole
PubChem CID112563033
Molecular FormulaC13H15FN2
Molecular Weight218.28 g/mol
Exact Mass218.12
IUPAC Name4-(3-fluoropiperidin-3-yl)-1H-indole
SMILESFC1(c2cccc3[nH]ccc23)CCCNC1
InChIInChI=1S/C13H15FN2/c14-13(6-2-7-15-9-13)11-3-1-4-12-10(11)5-8-16-12/h1,3-5,8,15-16H,2,6-7,9H2
InChIKeyBWCDTXRQLFCZBS-UHFFFAOYSA-N
XLogP2.72
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 83818332
[1-(1H-indol-4-yl)cyclobutyl]methanamine
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CID 112562991
2-(3-fluoropyrrolidin-3-yl)aniline
CID 105438750
(3S)-3-fluoro-3-(2-methylphenyl)pyrrolidine
CID 98774589
4-(1H-indol-4-yl)-1-methylazepan-4-ol
CID 115351908
3-(1H-indol-4-yl)-1-methylpiperidin-3-ol
CID 12900687
8-(1H-indol-4-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 115351923
3-(4-bromo-3-chloro-2-fluorophenyl)-3-fluoropiperidine
CID 106763885
3-(3-cyclobutylphenyl)-3-fluoropiperidine
CID 114607384
3-(5-chloro-2-methoxyphenyl)-3-fluoropiperidine
CID 83825082
1-[3-(3-fluoropiperidin-3-yl)phenyl]ethanone
CID 105477579

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoropiperidin-3-yl)-1H-indole?
The IUPAC name of 4-(3-fluoropiperidin-3-yl)-1H-indole (CID 112563033) is 4-(3-fluoropiperidin-3-yl)-1H-indole.
What is the SMILES notation for 4-(3-fluoropiperidin-3-yl)-1H-indole?
The canonical SMILES for 4-(3-fluoropiperidin-3-yl)-1H-indole is FC1(c2cccc3[nH]ccc23)CCCNC1.
What is the InChIKey of 4-(3-fluoropiperidin-3-yl)-1H-indole?
The InChIKey is BWCDTXRQLFCZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2/c14-13(6-2-7-15-9-13)11-3-1-4-12-10(11)5-8-16-12/h1,3-5,8,15-16H,2,6-7,9H2.
What are the key properties of 4-(3-fluoropiperidin-3-yl)-1H-indole?
4-(3-fluoropiperidin-3-yl)-1H-indole has a molecular weight of 218.28 g/mol, XLogP of 2.72, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoropiperidin-3-yl)-1H-indole is sourced from PubChem (CID 112563033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).