(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol

C13H18FNO — CID 80560260

IUPAC(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol
SMILESCc1ccc(F)cc1C(O)C1CCNCC1
InChIInChI=1S/C13H18FNO/c1-9-2-3-11(14)8-12(9)13(16)10-4-6-15-7-5-10/h2-3,8,10,13,15-16H,4-7H2,1H3
InChIKeyZGLPVKJTJZAUGI-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.17
Rot. Bonds2

About (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol

(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol (PubChem CID 80560260) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol.

Molecular Properties

Compound Name(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol
PubChem CID80560260
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol
SMILESCc1ccc(F)cc1C(O)C1CCNCC1
InChIInChI=1S/C13H18FNO/c1-9-2-3-11(14)8-12(9)13(16)10-4-6-15-7-5-10/h2-3,8,10,13,15-16H,4-7H2,1H3
InChIKeyZGLPVKJTJZAUGI-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

piperidin-4-yl-(2,4,5-trimethylphenyl)methanol
CID 80503850
(5-bromo-2-methylphenyl)-pyrrolidin-3-ylmethanol
CID 83693932
(5-fluoro-2-methylphenyl)-(oxan-3-yl)methanol
CID 63899537
cyclobutyl-(4-fluoro-2-methylphenyl)methanol
CID 64987002
cyclopentyl-(4-fluoro-2-methylphenyl)methanol
CID 62789449
2-cyclopentyl-1-(5-fluoro-2-methylphenyl)ethanol
CID 62608273
(1R,2S)-2-amino-1-cyclopropyl-2-(5-fluoro-2-methylphenyl)ethanol
CID 171267944
4-[(R)-(2,5-difluorophenyl)-fluoromethyl]piperidine;hydrochloride
CID 90039406
(R)-(4-fluoro-2-methylphenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314219
(4-fluoro-2-methylphenyl)-piperidin-3-ylmethanol
CID 80560290
(1R,2S)-2-amino-1-cyclopropyl-2-(5-fluoro-2-methylphenyl)ethanol;hydrochloride
CID 171267945
(1S,2R)-2-amino-1-cyclopropyl-2-(5-fluoro-2-methylphenyl)ethanol;hydrochloride
CID 171262268

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol?
The IUPAC name of (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol (CID 80560260) is (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol.
What is the SMILES notation for (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol?
The canonical SMILES for (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol is Cc1ccc(F)cc1C(O)C1CCNCC1.
What is the InChIKey of (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol?
The InChIKey is ZGLPVKJTJZAUGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c1-9-2-3-11(14)8-12(9)13(16)10-4-6-15-7-5-10/h2-3,8,10,13,15-16H,4-7H2,1H3.
What are the key properties of (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol?
(5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol has a molecular weight of 223.29 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-2-methylphenyl)-piperidin-4-ylmethanol is sourced from PubChem (CID 80560260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).