4-methoxy-3,3-dimethylpiperidine

C8H17NO — CID 89396674

IUPAC4-methoxy-3,3-dimethylpiperidine
SMILESCOC1CCNCC1(C)C
InChIInChI=1S/C8H17NO/c1-8(2)6-9-5-4-7(8)10-3/h7,9H,4-6H2,1-3H3
InChIKeyAIPZCOSIRHBIBO-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.02
Rot. Bonds1

About 4-methoxy-3,3-dimethylpiperidine

4-methoxy-3,3-dimethylpiperidine (PubChem CID 89396674) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 4-methoxy-3,3-dimethylpiperidine.

Molecular Properties

Compound Name4-methoxy-3,3-dimethylpiperidine
PubChem CID89396674
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name4-methoxy-3,3-dimethylpiperidine
SMILESCOC1CCNCC1(C)C
InChIInChI=1S/C8H17NO/c1-8(2)6-9-5-4-7(8)10-3/h7,9H,4-6H2,1-3H3
InChIKeyAIPZCOSIRHBIBO-UHFFFAOYSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3,3-dimethylpiperidine?
The IUPAC name of 4-methoxy-3,3-dimethylpiperidine (CID 89396674) is 4-methoxy-3,3-dimethylpiperidine.
What is the SMILES notation for 4-methoxy-3,3-dimethylpiperidine?
The canonical SMILES for 4-methoxy-3,3-dimethylpiperidine is COC1CCNCC1(C)C.
What is the InChIKey of 4-methoxy-3,3-dimethylpiperidine?
The InChIKey is AIPZCOSIRHBIBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-8(2)6-9-5-4-7(8)10-3/h7,9H,4-6H2,1-3H3.
What are the key properties of 4-methoxy-3,3-dimethylpiperidine?
4-methoxy-3,3-dimethylpiperidine has a molecular weight of 143.23 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3,3-dimethylpiperidine is sourced from PubChem (CID 89396674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).