(2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone

C17H22FNO2 — CID 79537046

IUPAC(2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1F)N1CCCCC1C1CCCC1O
InChIInChI=1S/C17H22FNO2/c18-14-8-2-1-6-12(14)17(21)19-11-4-3-9-15(19)13-7-5-10-16(13)20/h1-2,6,8,13,15-16,20H,3-5,7,9-11H2
InChIKeyXSXNAQMGILPNPB-UHFFFAOYSA-N
MW291.37 g/mol
LogP2.98
Rot. Bonds2

About (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone

(2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone (PubChem CID 79537046) has the molecular formula C17H22FNO2 and a molecular weight of 291.37 g/mol. Its IUPAC name is (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone
PubChem CID79537046
Molecular FormulaC17H22FNO2
Molecular Weight291.37 g/mol
Exact Mass291.16
IUPAC Name(2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1F)N1CCCCC1C1CCCC1O
InChIInChI=1S/C17H22FNO2/c18-14-8-2-1-6-12(14)17(21)19-11-4-3-9-15(19)13-7-5-10-16(13)20/h1-2,6,8,13,15-16,20H,3-5,7,9-11H2
InChIKeyXSXNAQMGILPNPB-UHFFFAOYSA-N
XLogP2.98
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,6-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone
CID 79539009
(2,4-difluorophenyl)-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]methanone
CID 79539007
[2-(2-hydroxycyclopentyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 79545297
(2-fluorophenyl)-(2-piperidin-4-ylpyrrolidin-1-yl)methanone
CID 60978270
[(2R)-2-[(1S,2S)-2-hydroxycyclohexyl]pyrrolidin-1-yl]-[2-(methoxymethyl)phenyl]methanone
CID 100699782
1-[1-(2-fluorobenzoyl)piperidin-2-yl]propan-2-one
CID 79549037
1-[(4R,4aR,9aR)-1-(2-fluorobenzoyl)-4-phenyl-3,4,4a,6,7,8,9,9a-octahydro-2H-pyrido[3,2-b]azepin-5-yl]ethanone
CID 92549341
[(4S,4aR,8aR)-4-hydroxy-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-phenylmethanone
CID 5338329
1-(2-fluorobenzoyl)pyrrolidine-2-carboxamide
CID 60659210
cyclohexyl-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone
CID 79545603
(2,3-difluorophenyl)-(2-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 63256799
(2-fluoro-3-methylphenyl)-[3-(2-hydroxycyclopentyl)morpholin-4-yl]methanone
CID 128987900

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone?
The IUPAC name of (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone (CID 79537046) is (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone.
What is the SMILES notation for (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone?
The canonical SMILES for (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone is O=C(c1ccccc1F)N1CCCCC1C1CCCC1O.
What is the InChIKey of (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone?
The InChIKey is XSXNAQMGILPNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22FNO2/c18-14-8-2-1-6-12(14)17(21)19-11-4-3-9-15(19)13-7-5-10-16(13)20/h1-2,6,8,13,15-16,20H,3-5,7,9-11H2.
What are the key properties of (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone?
(2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone has a molecular weight of 291.37 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone is sourced from PubChem (CID 79537046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).