(1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol

C14H18FNO — CID 90077861

IUPAC(1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol
SMILESO[C@@H]1Cc2ccc(F)cc2[C@H]1N1CCCCC1
InChIInChI=1S/C14H18FNO/c15-11-5-4-10-8-13(17)14(12(10)9-11)16-6-2-1-3-7-16/h4-5,9,13-14,17H,1-3,6-8H2/t13-,14-/m1/s1
InChIKeySRKHSIJQCRUCOS-ZIAGYGMSSA-N
MW235.30 g/mol
LogP2.27
Rot. Bonds1

About (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol

(1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol (PubChem CID 90077861) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol.

Molecular Properties

Compound Name(1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol
PubChem CID90077861
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name(1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol
SMILESO[C@@H]1Cc2ccc(F)cc2[C@H]1N1CCCCC1
InChIInChI=1S/C14H18FNO/c15-11-5-4-10-8-13(17)14(12(10)9-11)16-6-2-1-3-7-16/h4-5,9,13-14,17H,1-3,6-8H2/t13-,14-/m1/s1
InChIKeySRKHSIJQCRUCOS-ZIAGYGMSSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,2S)-1-pyrrolidin-1-yl-2,3-dihydro-1H-inden-2-ol
CID 14126785
(7S)-4-fluorobicyclo[4.2.0]octa-1(6),2,4-trien-7-amine;hydrochloride
CID 162342276
4-fluoro-N-methylbicyclo[4.2.0]octa-1(6),2,4-trien-7-amine
CID 105429571
(4S)-7-fluoro-4-piperidin-1-yl-1,2,3,4-tetrahydroisoquinoline
CID 9169081
(4S)-7-fluoro-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroisoquinoline
CID 9169066
6-fluoro-2-methyl-N-(2-methylcyclopropyl)-2,3-dihydro-1H-inden-1-amine
CID 115716856
(1R,2R)-1-pyrrolidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 14476580
[(7S)-4-fluoro-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methanamine
CID 98041428
2-(5-fluoro-2-methylphenyl)-1-hydroxypiperidine
CID 159531377
6-chloro-8-fluoro-4-piperidin-1-yl-3,4-dihydro-2H-chromen-3-ol
CID 82188650
2-amino-7-fluoro-1,2,3,4-tetrahydronaphthalen-1-ol;hydrochloride
CID 71432297
(1R,2R)-1-[(3R)-3-(4-chlorophenyl)-4-(2,4-dichlorophenyl)piperazin-1-yl]-5-fluoro-2,3-dihydro-1H-inden-2-ol
CID 59570647

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol?
The IUPAC name of (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol (CID 90077861) is (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol.
What is the SMILES notation for (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol?
The canonical SMILES for (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol is O[C@@H]1Cc2ccc(F)cc2[C@H]1N1CCCCC1.
What is the InChIKey of (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol?
The InChIKey is SRKHSIJQCRUCOS-ZIAGYGMSSA-N. The full InChI is InChI=1S/C14H18FNO/c15-11-5-4-10-8-13(17)14(12(10)9-11)16-6-2-1-3-7-16/h4-5,9,13-14,17H,1-3,6-8H2/t13-,14-/m1/s1.
What are the key properties of (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol?
(1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol has a molecular weight of 235.30 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-6-fluoro-1-piperidin-1-yl-2,3-dihydro-1H-inden-2-ol is sourced from PubChem (CID 90077861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).