4-propoxypiperidine

C8H17NO — CID 11492037

IUPAC4-propoxypiperidine
SMILESCCCOC1CCNCC1
InChIInChI=1S/C8H17NO/c1-2-7-10-8-3-5-9-6-4-8/h8-9H,2-7H2,1H3
InChIKeyVOWMRECKIQVVPP-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.16
Rot. Bonds3

About 4-propoxypiperidine

4-propoxypiperidine (PubChem CID 11492037) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 4-propoxypiperidine.

Molecular Properties

Compound Name4-propoxypiperidine
PubChem CID11492037
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name4-propoxypiperidine
SMILESCCCOC1CCNCC1
InChIInChI=1S/C8H17NO/c1-2-7-10-8-3-5-9-6-4-8/h8-9H,2-7H2,1H3
InChIKeyVOWMRECKIQVVPP-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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 4-propoxypiperidine?
The IUPAC name of 4-propoxypiperidine (CID 11492037) is 4-propoxypiperidine.
What is the SMILES notation for 4-propoxypiperidine?
The canonical SMILES for 4-propoxypiperidine is CCCOC1CCNCC1.
What is the InChIKey of 4-propoxypiperidine?
The InChIKey is VOWMRECKIQVVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-2-7-10-8-3-5-9-6-4-8/h8-9H,2-7H2,1H3.
What are the key properties of 4-propoxypiperidine?
4-propoxypiperidine has a molecular weight of 143.23 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propoxypiperidine is sourced from PubChem (CID 11492037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).