4-(oxolan-2-ylmethyl)piperidine

C10H19NO — CID 67123011

IUPAC4-(oxolan-2-ylmethyl)piperidine
SMILESC1COC(CC2CCNCC2)C1
InChIInChI=1S/C10H19NO/c1-2-10(12-7-1)8-9-3-5-11-6-4-9/h9-11H,1-8H2
InChIKeyULYWKNNDUKLMLT-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.56
Rot. Bonds2

About 4-(oxolan-2-ylmethyl)piperidine

4-(oxolan-2-ylmethyl)piperidine (PubChem CID 67123011) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 4-(oxolan-2-ylmethyl)piperidine.

Molecular Properties

Compound Name4-(oxolan-2-ylmethyl)piperidine
PubChem CID67123011
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name4-(oxolan-2-ylmethyl)piperidine
SMILESC1COC(CC2CCNCC2)C1
InChIInChI=1S/C10H19NO/c1-2-10(12-7-1)8-9-3-5-11-6-4-9/h9-11H,1-8H2
InChIKeyULYWKNNDUKLMLT-UHFFFAOYSA-N
XLogP1.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-2-ylmethyl)piperidine?
The IUPAC name of 4-(oxolan-2-ylmethyl)piperidine (CID 67123011) is 4-(oxolan-2-ylmethyl)piperidine.
What is the SMILES notation for 4-(oxolan-2-ylmethyl)piperidine?
The canonical SMILES for 4-(oxolan-2-ylmethyl)piperidine is C1COC(CC2CCNCC2)C1.
What is the InChIKey of 4-(oxolan-2-ylmethyl)piperidine?
The InChIKey is ULYWKNNDUKLMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-10(12-7-1)8-9-3-5-11-6-4-9/h9-11H,1-8H2.
What are the key properties of 4-(oxolan-2-ylmethyl)piperidine?
4-(oxolan-2-ylmethyl)piperidine has a molecular weight of 169.27 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-2-ylmethyl)piperidine is sourced from PubChem (CID 67123011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).