2-(1-methylpiperidin-3-yl)-1,3-oxazolidine

C9H18N2O — CID 117225662

IUPAC2-(1-methylpiperidin-3-yl)-1,3-oxazolidine
SMILESCN1CCCC(C2NCCO2)C1
InChIInChI=1S/C9H18N2O/c1-11-5-2-3-8(7-11)9-10-4-6-12-9/h8-10H,2-7H2,1H3
InChIKeyGUZMAWUGCWEGPC-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.27
Rot. Bonds1

About 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine

2-(1-methylpiperidin-3-yl)-1,3-oxazolidine (PubChem CID 117225662) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine.

Molecular Properties

Compound Name2-(1-methylpiperidin-3-yl)-1,3-oxazolidine
PubChem CID117225662
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-(1-methylpiperidin-3-yl)-1,3-oxazolidine
SMILESCN1CCCC(C2NCCO2)C1
InChIInChI=1S/C9H18N2O/c1-11-5-2-3-8(7-11)9-10-4-6-12-9/h8-10H,2-7H2,1H3
InChIKeyGUZMAWUGCWEGPC-UHFFFAOYSA-N
XLogP0.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine?
The IUPAC name of 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine (CID 117225662) is 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine.
What is the SMILES notation for 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine?
The canonical SMILES for 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine is CN1CCCC(C2NCCO2)C1.
What is the InChIKey of 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine?
The InChIKey is GUZMAWUGCWEGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-11-5-2-3-8(7-11)9-10-4-6-12-9/h8-10H,2-7H2,1H3.
What are the key properties of 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine?
2-(1-methylpiperidin-3-yl)-1,3-oxazolidine has a molecular weight of 170.26 g/mol, XLogP of 0.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperidin-3-yl)-1,3-oxazolidine is sourced from PubChem (CID 117225662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).