(2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone

C13H16FNO2 — CID 171906066

IUPAC(2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone
SMILESCc1cc(F)c(C(=O)N2CCCCC2)cc1O
InChIInChI=1S/C13H16FNO2/c1-9-7-11(14)10(8-12(9)16)13(17)15-5-3-2-4-6-15/h7-8,16H,2-6H2,1H3
InChIKeyUMUSNVQNTVMEQM-UHFFFAOYSA-N
MW237.27 g/mol
LogP2.47
Rot. Bonds1

About (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone

(2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone (PubChem CID 171906066) has the molecular formula C13H16FNO2 and a molecular weight of 237.27 g/mol. Its IUPAC name is (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone
PubChem CID171906066
Molecular FormulaC13H16FNO2
Molecular Weight237.27 g/mol
Exact Mass237.12
IUPAC Name(2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone
SMILESCc1cc(F)c(C(=O)N2CCCCC2)cc1O
InChIInChI=1S/C13H16FNO2/c1-9-7-11(14)10(8-12(9)16)13(17)15-5-3-2-4-6-15/h7-8,16H,2-6H2,1H3
InChIKeyUMUSNVQNTVMEQM-UHFFFAOYSA-N
XLogP2.47
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone 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

(5-bromo-2-fluoro-4-methylphenyl)-piperidin-1-ylmethanone
CID 146171182
(5-amino-4-fluoro-2-methylphenyl)-(azepan-1-yl)methanone
CID 114271606
(2-bromo-5-fluoro-4-methylphenyl)-piperidin-1-ylmethanone
CID 172913969
azepan-1-yl-(4-fluoro-2-methylphenyl)methanone
CID 112702240
(4-chloro-2,5-difluorophenyl)-pyrrolidin-1-ylmethanone
CID 82772045
azepan-1-yl-(5-chloro-2-fluorophenyl)methanone
CID 60675642
azetidin-1-yl-(2-fluoro-5-methylphenyl)methanone
CID 118296976
azepan-1-yl-(4-fluoro-2-hydroxyphenyl)methanone
CID 113304514
(5-amino-2-fluoro-3-methylphenyl)-piperidin-1-ylmethanone
CID 103295707
azocan-1-yl-(5-bromo-2-fluorophenyl)methanone
CID 28801538
azocan-1-yl-(2-fluoro-4-methoxyphenyl)methanone
CID 113218844
[6-fluoro-2-(4-fluorophenyl)-1,3-benzodioxol-5-yl]-piperidin-1-ylmethanone
CID 142857708

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone?
The IUPAC name of (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone (CID 171906066) is (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone.
What is the SMILES notation for (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone?
The canonical SMILES for (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone is Cc1cc(F)c(C(=O)N2CCCCC2)cc1O.
What is the InChIKey of (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone?
The InChIKey is UMUSNVQNTVMEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FNO2/c1-9-7-11(14)10(8-12(9)16)13(17)15-5-3-2-4-6-15/h7-8,16H,2-6H2,1H3.
What are the key properties of (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone?
(2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone has a molecular weight of 237.27 g/mol, XLogP of 2.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-5-hydroxy-4-methylphenyl)-piperidin-1-ylmethanone is sourced from PubChem (CID 171906066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).