6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole

C13H17FN2 — CID 105475984

IUPAC6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole
SMILESFc1ccc2c(c1)NCC2C1CCNCC1
InChIInChI=1S/C13H17FN2/c14-10-1-2-11-12(8-16-13(11)7-10)9-3-5-15-6-4-9/h1-2,7,9,12,15-16H,3-6,8H2
InChIKeyPJTWRFOKXFFBJG-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.33
Rot. Bonds1

About 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole

6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole (PubChem CID 105475984) has the molecular formula C13H17FN2 and a molecular weight of 220.29 g/mol. Its IUPAC name is 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole
PubChem CID105475984
Molecular FormulaC13H17FN2
Molecular Weight220.29 g/mol
Exact Mass220.14
IUPAC Name6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole
SMILESFc1ccc2c(c1)NCC2C1CCNCC1
InChIInChI=1S/C13H17FN2/c14-10-1-2-11-12(8-16-13(11)7-10)9-3-5-15-6-4-9/h1-2,7,9,12,15-16H,3-6,8H2
InChIKeyPJTWRFOKXFFBJG-UHFFFAOYSA-N
XLogP2.33
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-3-piperidin-4-yl-2,3-dihydro-1H-indole
CID 105498634
[4-(6-fluoro-2,3-dihydro-1H-indol-3-yl)piperidin-1-yl]-methyl-dimethylidene-λ6-sulfane
CID 144855096
(4S)-7-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
CID 95240605
7-fluoro-1,2,3,4-tetrahydroquinolin-4-amine
CID 54594245
6-fluoro-N-methyl-2,3-dihydro-1H-indol-3-amine
CID 84739527
5-fluoro-2-[(3S)-pyrrolidin-3-yl]phenol
CID 96744761
8-fluoro-5-methyl-2,3,4,5-tetrahydro-1H-1-benzazepine
CID 84718205
5-fluoro-2-piperidin-4-ylaniline
CID 117103758
4-(2,4-difluorophenyl)-3-methylpiperidine
CID 66279713
6-tert-butyl-3-(1-methylpiperidin-4-yl)-2,3-dihydro-1H-indole
CID 112710647
(3R)-3-[(1R)-6-fluoro-3,4-dihydro-1H-isochromen-1-yl]pyrrolidine
CID 122493937
4-(4-fluoro-2-methylphenyl)-3-methylpiperidine
CID 66277962

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole?
The IUPAC name of 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole (CID 105475984) is 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole.
What is the SMILES notation for 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole?
The canonical SMILES for 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole is Fc1ccc2c(c1)NCC2C1CCNCC1.
What is the InChIKey of 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole?
The InChIKey is PJTWRFOKXFFBJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2/c14-10-1-2-11-12(8-16-13(11)7-10)9-3-5-15-6-4-9/h1-2,7,9,12,15-16H,3-6,8H2.
What are the key properties of 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole?
6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole has a molecular weight of 220.29 g/mol, XLogP of 2.33, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-piperidin-4-yl-2,3-dihydro-1H-indole is sourced from PubChem (CID 105475984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).