ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol

C11H25NO2 — CID 172575983

IUPACethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol
SMILESCC.CCN1CCCC(O)(COC)C1
InChIInChI=1S/C9H19NO2.C2H6/c1-3-10-6-4-5-9(11,7-10)8-12-2;1-2/h11H,3-8H2,1-2H3;1-2H3
InChIKeyNDQQGCBOLXGKSK-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.51
Rot. Bonds3

About ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol

ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol (PubChem CID 172575983) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol.

Molecular Properties

Compound Nameethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol
PubChem CID172575983
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Nameethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol
SMILESCC.CCN1CCCC(O)(COC)C1
InChIInChI=1S/C9H19NO2.C2H6/c1-3-10-6-4-5-9(11,7-10)8-12-2;1-2/h11H,3-8H2,1-2H3;1-2H3
InChIKeyNDQQGCBOLXGKSK-UHFFFAOYSA-N
XLogP1.51
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol?
The IUPAC name of ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol (CID 172575983) is ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol.
What is the SMILES notation for ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol?
The canonical SMILES for ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol is CC.CCN1CCCC(O)(COC)C1.
What is the InChIKey of ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol?
The InChIKey is NDQQGCBOLXGKSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2.C2H6/c1-3-10-6-4-5-9(11,7-10)8-12-2;1-2/h11H,3-8H2,1-2H3;1-2H3.
What are the key properties of ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol?
ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol has a molecular weight of 203.33 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-3-(methoxymethyl)piperidin-3-ol is sourced from PubChem (CID 172575983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).