4-(oxolan-2-yl)piperidine

C9H17NO — CID 55264246

IUPAC4-(oxolan-2-yl)piperidine
SMILESC1COC(C2CCNCC2)C1
InChIInChI=1S/C9H17NO/c1-2-9(11-7-1)8-3-5-10-6-4-8/h8-10H,1-7H2
InChIKeyMDZMCSFGQPLQBP-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds1

About 4-(oxolan-2-yl)piperidine

4-(oxolan-2-yl)piperidine (PubChem CID 55264246) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 4-(oxolan-2-yl)piperidine.

Molecular Properties

Compound Name4-(oxolan-2-yl)piperidine
PubChem CID55264246
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name4-(oxolan-2-yl)piperidine
SMILESC1COC(C2CCNCC2)C1
InChIInChI=1S/C9H17NO/c1-2-9(11-7-1)8-3-5-10-6-4-8/h8-10H,1-7H2
InChIKeyMDZMCSFGQPLQBP-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-2-yl)piperidine?
The IUPAC name of 4-(oxolan-2-yl)piperidine (CID 55264246) is 4-(oxolan-2-yl)piperidine.
What is the SMILES notation for 4-(oxolan-2-yl)piperidine?
The canonical SMILES for 4-(oxolan-2-yl)piperidine is C1COC(C2CCNCC2)C1.
What is the InChIKey of 4-(oxolan-2-yl)piperidine?
The InChIKey is MDZMCSFGQPLQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-2-9(11-7-1)8-3-5-10-6-4-8/h8-10H,1-7H2.
What are the key properties of 4-(oxolan-2-yl)piperidine?
4-(oxolan-2-yl)piperidine has a molecular weight of 155.24 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-2-yl)piperidine is sourced from PubChem (CID 55264246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).