5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine

C11H23NO — CID 15326038

IUPAC5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine
SMILESCOC1CN(C(C)C)CC(C)(C)C1
InChIInChI=1S/C11H23NO/c1-9(2)12-7-10(13-5)6-11(3,4)8-12/h9-10H,6-8H2,1-5H3
InChIKeyVMOKQSBOKPZZOW-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.14
Rot. Bonds2

About 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine

5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine (PubChem CID 15326038) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine
PubChem CID15326038
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine
SMILESCOC1CN(C(C)C)CC(C)(C)C1
InChIInChI=1S/C11H23NO/c1-9(2)12-7-10(13-5)6-11(3,4)8-12/h9-10H,6-8H2,1-5H3
InChIKeyVMOKQSBOKPZZOW-UHFFFAOYSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine?
The IUPAC name of 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine (CID 15326038) is 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine.
What is the SMILES notation for 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine?
The canonical SMILES for 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine is COC1CN(C(C)C)CC(C)(C)C1.
What is the InChIKey of 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine?
The InChIKey is VMOKQSBOKPZZOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(2)12-7-10(13-5)6-11(3,4)8-12/h9-10H,6-8H2,1-5H3.
What are the key properties of 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine?
5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine has a molecular weight of 185.31 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3,3-dimethyl-1-propan-2-ylpiperidine is sourced from PubChem (CID 15326038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).