(5-fluoro-3,5-dimethylpiperidin-3-yl)methanol

C8H16FNO — CID 176680289

IUPAC(5-fluoro-3,5-dimethylpiperidin-3-yl)methanol
SMILESCC1(F)CNCC(C)(CO)C1
InChIInChI=1S/C8H16FNO/c1-7(6-11)3-8(2,9)5-10-4-7/h10-11H,3-6H2,1-2H3
InChIKeyLDYVSXMXQRPIIP-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.71
Rot. Bonds1

About (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol

(5-fluoro-3,5-dimethylpiperidin-3-yl)methanol (PubChem CID 176680289) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol.

Molecular Properties

Compound Name(5-fluoro-3,5-dimethylpiperidin-3-yl)methanol
PubChem CID176680289
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name(5-fluoro-3,5-dimethylpiperidin-3-yl)methanol
SMILESCC1(F)CNCC(C)(CO)C1
InChIInChI=1S/C8H16FNO/c1-7(6-11)3-8(2,9)5-10-4-7/h10-11H,3-6H2,1-2H3
InChIKeyLDYVSXMXQRPIIP-UHFFFAOYSA-N
XLogP0.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1,3-Dimethylpiperidin-3-yl)methanol
CID 44827703
2-Methyl-2-(piperidin-4-yl)propan-1-ol
CID 13478140
(3-Methylpiperidin-3-yl)methanol
CID 19594566
(3-Ethylpiperidin-3-yl)methanol hydrochloride
CID 75467424
2-(4-Methylpiperidin-4-yl)ethan-1-ol hydrochloride
CID 165761211
(3-Fluoropiperidin-3-yl)methanol hydrochloride
CID 71742825
(3-(Propan-2-yl)piperidin-3-yl)methanol
CID 84072936
[3-(Methoxymethyl)piperidin-3-yl]methanol
CID 103984996
(3-(Hydroxymethyl)piperidin-3-yl)methanol hydrochloride
CID 146121139
{5-Methyl-3-azabicyclo[3.1.1]heptan-1-yl}methanol hydrochloride
CID 165592155
[3-(Hydroxymethyl)piperidin-3-yl]methanol
CID 21186527
(3-Ethylpiperidin-3-YL)methanol
CID 44827704

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol?
The IUPAC name of (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol (CID 176680289) is (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol.
What is the SMILES notation for (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol?
The canonical SMILES for (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol is CC1(F)CNCC(C)(CO)C1.
What is the InChIKey of (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol?
The InChIKey is LDYVSXMXQRPIIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c1-7(6-11)3-8(2,9)5-10-4-7/h10-11H,3-6H2,1-2H3.
What are the key properties of (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol?
(5-fluoro-3,5-dimethylpiperidin-3-yl)methanol has a molecular weight of 161.22 g/mol, XLogP of 0.71, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3,5-dimethylpiperidin-3-yl)methanol is sourced from PubChem (CID 176680289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).