3-(5-fluoro-2-methylphenyl)piperidin-3-ol

C12H16FNO — CID 63587351

IUPAC3-(5-fluoro-2-methylphenyl)piperidin-3-ol
SMILESCc1ccc(F)cc1C1(O)CCCNC1
InChIInChI=1S/C12H16FNO/c1-9-3-4-10(13)7-11(9)12(15)5-2-6-14-8-12/h3-4,7,14-15H,2,5-6,8H2,1H3
InChIKeyDYDVFOBWONXFSQ-UHFFFAOYSA-N
MW209.26 g/mol
LogP1.71
Rot. Bonds1

About 3-(5-fluoro-2-methylphenyl)piperidin-3-ol

3-(5-fluoro-2-methylphenyl)piperidin-3-ol (PubChem CID 63587351) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 3-(5-fluoro-2-methylphenyl)piperidin-3-ol.

Molecular Properties

Compound Name3-(5-fluoro-2-methylphenyl)piperidin-3-ol
PubChem CID63587351
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name3-(5-fluoro-2-methylphenyl)piperidin-3-ol
SMILESCc1ccc(F)cc1C1(O)CCCNC1
InChIInChI=1S/C12H16FNO/c1-9-3-4-10(13)7-11(9)12(15)5-2-6-14-8-12/h3-4,7,14-15H,2,5-6,8H2,1H3
InChIKeyDYDVFOBWONXFSQ-UHFFFAOYSA-N
XLogP1.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoro-2-methylphenyl)piperidin-3-ol?
The IUPAC name of 3-(5-fluoro-2-methylphenyl)piperidin-3-ol (CID 63587351) is 3-(5-fluoro-2-methylphenyl)piperidin-3-ol.
What is the SMILES notation for 3-(5-fluoro-2-methylphenyl)piperidin-3-ol?
The canonical SMILES for 3-(5-fluoro-2-methylphenyl)piperidin-3-ol is Cc1ccc(F)cc1C1(O)CCCNC1.
What is the InChIKey of 3-(5-fluoro-2-methylphenyl)piperidin-3-ol?
The InChIKey is DYDVFOBWONXFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-9-3-4-10(13)7-11(9)12(15)5-2-6-14-8-12/h3-4,7,14-15H,2,5-6,8H2,1H3.
What are the key properties of 3-(5-fluoro-2-methylphenyl)piperidin-3-ol?
3-(5-fluoro-2-methylphenyl)piperidin-3-ol has a molecular weight of 209.26 g/mol, XLogP of 1.71, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoro-2-methylphenyl)piperidin-3-ol is sourced from PubChem (CID 63587351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).