ethane;5-(hydroxymethyl)piperidin-3-ol

C10H25NO2 — CID 143590323

IUPACethane;5-(hydroxymethyl)piperidin-3-ol
SMILESCC.CC.OCC1CNCC(O)C1
InChIInChI=1S/C6H13NO2.2C2H6/c8-4-5-1-6(9)3-7-2-5;2*1-2/h5-9H,1-4H2;2*1-2H3
InChIKeyWMMNQFBLNSZLFN-UHFFFAOYSA-N
MW191.31 g/mol
LogP1.00
Rot. Bonds1

About ethane;5-(hydroxymethyl)piperidin-3-ol

ethane;5-(hydroxymethyl)piperidin-3-ol (PubChem CID 143590323) has the molecular formula C10H25NO2 and a molecular weight of 191.31 g/mol. Its IUPAC name is ethane;5-(hydroxymethyl)piperidin-3-ol.

Molecular Properties

Compound Nameethane;5-(hydroxymethyl)piperidin-3-ol
PubChem CID143590323
Molecular FormulaC10H25NO2
Molecular Weight191.31 g/mol
Exact Mass191.19
IUPAC Nameethane;5-(hydroxymethyl)piperidin-3-ol
SMILESCC.CC.OCC1CNCC(O)C1
InChIInChI=1S/C6H13NO2.2C2H6/c8-4-5-1-6(9)3-7-2-5;2*1-2/h5-9H,1-4H2;2*1-2H3
InChIKeyWMMNQFBLNSZLFN-UHFFFAOYSA-N
XLogP1.00
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.31
LogP ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;5-(hydroxymethyl)piperidin-3-ol?
The IUPAC name of ethane;5-(hydroxymethyl)piperidin-3-ol (CID 143590323) is ethane;5-(hydroxymethyl)piperidin-3-ol.
What is the SMILES notation for ethane;5-(hydroxymethyl)piperidin-3-ol?
The canonical SMILES for ethane;5-(hydroxymethyl)piperidin-3-ol is CC.CC.OCC1CNCC(O)C1.
What is the InChIKey of ethane;5-(hydroxymethyl)piperidin-3-ol?
The InChIKey is WMMNQFBLNSZLFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2.2C2H6/c8-4-5-1-6(9)3-7-2-5;2*1-2/h5-9H,1-4H2;2*1-2H3.
What are the key properties of ethane;5-(hydroxymethyl)piperidin-3-ol?
ethane;5-(hydroxymethyl)piperidin-3-ol has a molecular weight of 191.31 g/mol, XLogP of 1.00, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-(hydroxymethyl)piperidin-3-ol is sourced from PubChem (CID 143590323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).