(3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol

C10H19NO3 — CID 126846681

IUPAC(3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol
SMILESCOC1CCN([C@@H]2COC[C@H]2O)CC1
InChIInChI=1S/C10H19NO3/c1-13-8-2-4-11(5-3-8)9-6-14-7-10(9)12/h8-10,12H,2-7H2,1H3/t9-,10-/m1/s1
InChIKeyISDXTNFPWIYIQC-NXEZZACHSA-N
MW201.27 g/mol
LogP-0.14
Rot. Bonds2

About (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol

(3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol (PubChem CID 126846681) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol.

Molecular Properties

Compound Name(3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol
PubChem CID126846681
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name(3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol
SMILESCOC1CCN([C@@H]2COC[C@H]2O)CC1
InChIInChI=1S/C10H19NO3/c1-13-8-2-4-11(5-3-8)9-6-14-7-10(9)12/h8-10,12H,2-7H2,1H3/t9-,10-/m1/s1
InChIKeyISDXTNFPWIYIQC-NXEZZACHSA-N
XLogP-0.14
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-methoxypyrrolidin-1-yl)oxan-4-ol
CID 103537640
(3S,4R)-4-(4-aminopiperidin-1-yl)oxolan-3-ol
CID 126846710
4-piperazin-1-yloxolan-3-ol
CID 126973224
(3R,4R)-4-(4-propan-2-ylpiperazin-1-yl)oxolan-3-ol
CID 164848124
(3S)-3-methoxy-1-(oxetan-3-yl)pyrrolidine
CID 118553663
4-[(4-methoxycyclohexyl)amino]oxolan-3-ol
CID 104530548
4-(1,1-dioxo-1,4-thiazinan-4-yl)oxolan-3-ol
CID 130503022
[2-(4-methoxypiperidin-1-yl)cyclopropyl]methanol
CID 127013181
trans-(1R,2R)-2-(3-methoxypyrrolidin-1-yl)cyclohexan-1-ol
CID 103536869
1-[(4S)-4-hydroxyoxolan-3-yl]-4-methylpyrrolidin-3-ol
CID 130676350
2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420002
4-(3-fluoroazetidin-1-yl)oxolan-3-ol
CID 126856878

Frequently Asked Questions

What is the IUPAC name of (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol?
The IUPAC name of (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol (CID 126846681) is (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol.
What is the SMILES notation for (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol?
The canonical SMILES for (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol is COC1CCN([C@@H]2COC[C@H]2O)CC1.
What is the InChIKey of (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol?
The InChIKey is ISDXTNFPWIYIQC-NXEZZACHSA-N. The full InChI is InChI=1S/C10H19NO3/c1-13-8-2-4-11(5-3-8)9-6-14-7-10(9)12/h8-10,12H,2-7H2,1H3/t9-,10-/m1/s1.
What are the key properties of (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol?
(3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol has a molecular weight of 201.27 g/mol, XLogP of -0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol is sourced from PubChem (CID 126846681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).