3-propan-2-yloxypiperidine

C8H17NO — CID 53409756

IUPAC3-propan-2-yloxypiperidine
SMILESCC(C)OC1CCCNC1
InChIInChI=1S/C8H17NO/c1-7(2)10-8-4-3-5-9-6-8/h7-9H,3-6H2,1-2H3
InChIKeyOIELPWFWJPVOLK-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.16
Rot. Bonds2

About 3-propan-2-yloxypiperidine

3-propan-2-yloxypiperidine (PubChem CID 53409756) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 3-propan-2-yloxypiperidine.

Molecular Properties

Compound Name3-propan-2-yloxypiperidine
PubChem CID53409756
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name3-propan-2-yloxypiperidine
SMILESCC(C)OC1CCCNC1
InChIInChI=1S/C8H17NO/c1-7(2)10-8-4-3-5-9-6-8/h7-9H,3-6H2,1-2H3
InChIKeyOIELPWFWJPVOLK-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yloxypiperidine?
The IUPAC name of 3-propan-2-yloxypiperidine (CID 53409756) is 3-propan-2-yloxypiperidine.
What is the SMILES notation for 3-propan-2-yloxypiperidine?
The canonical SMILES for 3-propan-2-yloxypiperidine is CC(C)OC1CCCNC1.
What is the InChIKey of 3-propan-2-yloxypiperidine?
The InChIKey is OIELPWFWJPVOLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)10-8-4-3-5-9-6-8/h7-9H,3-6H2,1-2H3.
What are the key properties of 3-propan-2-yloxypiperidine?
3-propan-2-yloxypiperidine has a molecular weight of 143.23 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yloxypiperidine is sourced from PubChem (CID 53409756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).