1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol

C14H20FNO — CID 63586093

IUPAC1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol
SMILESCc1ccc(F)c(C(C)(O)C2CCCNC2)c1
InChIInChI=1S/C14H20FNO/c1-10-5-6-13(15)12(8-10)14(2,17)11-4-3-7-16-9-11/h5-6,8,11,16-17H,3-4,7,9H2,1-2H3
InChIKeyQSBVZJPCCNSELX-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.34
Rot. Bonds2

About 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol

1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol (PubChem CID 63586093) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol.

Molecular Properties

Compound Name1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol
PubChem CID63586093
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol
SMILESCc1ccc(F)c(C(C)(O)C2CCCNC2)c1
InChIInChI=1S/C14H20FNO/c1-10-5-6-13(15)12(8-10)14(2,17)11-4-3-7-16-9-11/h5-6,8,11,16-17H,3-4,7,9H2,1-2H3
InChIKeyQSBVZJPCCNSELX-UHFFFAOYSA-N
XLogP2.34
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-dimethylphenyl)-1-piperidin-3-ylethanol
CID 63586450
1-piperidin-3-yl-1-(2,3,4-trifluorophenyl)ethanol
CID 63587550
N-[4-(2-fluoro-5-methylphenyl)-4-hydroxy-4-piperidin-3-ylbutyl]acetamide
CID 67193008
3-[1-(5-bromo-2-fluorophenyl)-1-fluoroethyl]piperidine
CID 112564899
3-[(2,4-dimethylphenyl)-difluoromethyl]piperidine
CID 116838867
1-(4-tert-butylphenyl)-1-piperidin-3-ylethanol
CID 63586623
1-(5-methyl-1-benzofuran-2-yl)-1-piperidin-3-ylethanol
CID 114723249
1-(4-methoxy-2,5-dimethylphenyl)-1-piperidin-3-ylethanol
CID 82303353
1-fluoro-2,4-dimethylbenzene;3-methylpiperidine
CID 146172473
1-(2-chloro-4-methylphenyl)-2-piperidin-3-ylpropan-2-ol
CID 106866125
1-cyclopropyl-1-(2-fluoro-5-methylphenyl)ethanamine
CID 82235884
1-(4-aminophenyl)-1-piperidin-3-ylethanol
CID 115032208

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol?
The IUPAC name of 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol (CID 63586093) is 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol.
What is the SMILES notation for 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol?
The canonical SMILES for 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol is Cc1ccc(F)c(C(C)(O)C2CCCNC2)c1.
What is the InChIKey of 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol?
The InChIKey is QSBVZJPCCNSELX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-10-5-6-13(15)12(8-10)14(2,17)11-4-3-7-16-9-11/h5-6,8,11,16-17H,3-4,7,9H2,1-2H3.
What are the key properties of 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol?
1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol has a molecular weight of 237.32 g/mol, XLogP of 2.34, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol is sourced from PubChem (CID 63586093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).