2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol

C11H23NO2 — CID 106939384

IUPAC2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol
SMILESCCC(C)(O)COCC1CCCNC1
InChIInChI=1S/C11H23NO2/c1-3-11(2,13)9-14-8-10-5-4-6-12-7-10/h10,12-13H,3-9H2,1-2H3
InChIKeyZBXNJKCAKLPNLI-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.16
Rot. Bonds5

About 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol

2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol (PubChem CID 106939384) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol
PubChem CID106939384
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol
SMILESCCC(C)(O)COCC1CCCNC1
InChIInChI=1S/C11H23NO2/c1-3-11(2,13)9-14-8-10-5-4-6-12-7-10/h10,12-13H,3-9H2,1-2H3
InChIKeyZBXNJKCAKLPNLI-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-(ethoxymethyl)piperidine
CID 42427178
(3S)-3-(ethoxymethyl)piperidine
CID 42427180
2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol
CID 106939814
3-(ethoxymethyl)piperidine;hydrochloride
CID 17178071
3-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]piperidine
CID 112587717
1-(piperidin-3-ylmethoxy)butan-2-ol
CID 106939364
1-(piperidin-3-ylmethoxy)propan-2-ol
CID 106937756
N-tert-butyl-2-(piperidin-3-ylmethoxy)acetamide
CID 62341241
3-(cyclopropylmethoxymethoxymethyl)piperidine
CID 106937752
2,2-dimethyl-4-(piperidin-3-ylmethoxy)butanenitrile
CID 65253359
tert-butyl-dimethyl-[[(3S)-piperidin-3-yl]methoxy]silane
CID 150934264
methyl 2-[[(3S)-piperidin-3-yl]methoxy]acetate
CID 169177589

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol?
The IUPAC name of 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol (CID 106939384) is 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol.
What is the SMILES notation for 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol?
The canonical SMILES for 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol is CCC(C)(O)COCC1CCCNC1.
What is the InChIKey of 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol?
The InChIKey is ZBXNJKCAKLPNLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-3-11(2,13)9-14-8-10-5-4-6-12-7-10/h10,12-13H,3-9H2,1-2H3.
What are the key properties of 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol?
2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol has a molecular weight of 201.31 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol is sourced from PubChem (CID 106939384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).