3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol

C14H23NO3 — CID 23823128

IUPAC3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CC(O)C(C(O)c2ccco2)C(C)(C)N1
InChIInChI=1S/C14H23NO3/c1-13(2)8-9(16)11(14(3,4)15-13)12(17)10-6-5-7-18-10/h5-7,9,11-12,15-17H,8H2,1-4H3
InChIKeyDPRUYJUWBFNAIE-UHFFFAOYSA-N
MW253.34 g/mol
LogP1.84
Rot. Bonds2

About 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol

3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol (PubChem CID 23823128) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol.

Molecular Properties

Compound Name3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol
PubChem CID23823128
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CC(O)C(C(O)c2ccco2)C(C)(C)N1
InChIInChI=1S/C14H23NO3/c1-13(2)8-9(16)11(14(3,4)15-13)12(17)10-6-5-7-18-10/h5-7,9,11-12,15-17H,8H2,1-4H3
InChIKeyDPRUYJUWBFNAIE-UHFFFAOYSA-N
XLogP1.84
TPSA65.63 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

furan-2-yl-(2,2,3,3-tetramethylcyclopropyl)methanol
CID 115797501
(1R,2R,3R,4R)-3-[furan-2-yl(hydroxy)methyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
CID 100951242
furan-2-yl(piperidin-4-yl)methanol
CID 55269917
(S)-cyclopropyl(furan-2-yl)methanol
CID 39235067
2-[(2,2-dimethylcyclopropyl)amino]-1-(furan-2-yl)ethanol
CID 61223910
(2,2-dimethylcyclohexyl)-(furan-2-yl)methanol
CID 107192265
(R)-[(1R,3R,5R)-6,6-dimethyl-2-methylidene-3-bicyclo[3.1.1]heptanyl]-(furan-2-yl)methanol
CID 122525698
furan-2-yl-[(2R)-pyrrolidin-2-yl]methanol
CID 164662005
(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol
CID 131175689
1,3-dithian-2-yl(furan-2-yl)methanol
CID 24777605
(2-ethylcyclohexyl)-(furan-2-yl)methanol
CID 63861285
furan-2-yl-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol
CID 63927710

Frequently Asked Questions

What is the IUPAC name of 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol?
The IUPAC name of 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol (CID 23823128) is 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol.
What is the SMILES notation for 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol?
The canonical SMILES for 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol is CC1(C)CC(O)C(C(O)c2ccco2)C(C)(C)N1.
What is the InChIKey of 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol?
The InChIKey is DPRUYJUWBFNAIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-13(2)8-9(16)11(14(3,4)15-13)12(17)10-6-5-7-18-10/h5-7,9,11-12,15-17H,8H2,1-4H3.
What are the key properties of 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol?
3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol has a molecular weight of 253.34 g/mol, XLogP of 1.84, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[furan-2-yl(hydroxy)methyl]-2,2,6,6-tetramethylpiperidin-4-ol is sourced from PubChem (CID 23823128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).