1,3,3-trimethyl-4-propan-2-yloxypiperidine

C11H23NO — CID 129256143

IUPAC1,3,3-trimethyl-4-propan-2-yloxypiperidine
SMILESCC(C)OC1CCN(C)CC1(C)C
InChIInChI=1S/C11H23NO/c1-9(2)13-10-6-7-12(5)8-11(10,3)4/h9-10H,6-8H2,1-5H3
InChIKeyZAWMBFOAKYKMNF-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.14
Rot. Bonds2

About 1,3,3-trimethyl-4-propan-2-yloxypiperidine

1,3,3-trimethyl-4-propan-2-yloxypiperidine (PubChem CID 129256143) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1,3,3-trimethyl-4-propan-2-yloxypiperidine.

Molecular Properties

Compound Name1,3,3-trimethyl-4-propan-2-yloxypiperidine
PubChem CID129256143
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1,3,3-trimethyl-4-propan-2-yloxypiperidine
SMILESCC(C)OC1CCN(C)CC1(C)C
InChIInChI=1S/C11H23NO/c1-9(2)13-10-6-7-12(5)8-11(10,3)4/h9-10H,6-8H2,1-5H3
InChIKeyZAWMBFOAKYKMNF-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 1,3,3-trimethyl-4-propan-2-yloxypiperidine?
The IUPAC name of 1,3,3-trimethyl-4-propan-2-yloxypiperidine (CID 129256143) is 1,3,3-trimethyl-4-propan-2-yloxypiperidine.
What is the SMILES notation for 1,3,3-trimethyl-4-propan-2-yloxypiperidine?
The canonical SMILES for 1,3,3-trimethyl-4-propan-2-yloxypiperidine is CC(C)OC1CCN(C)CC1(C)C.
What is the InChIKey of 1,3,3-trimethyl-4-propan-2-yloxypiperidine?
The InChIKey is ZAWMBFOAKYKMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(2)13-10-6-7-12(5)8-11(10,3)4/h9-10H,6-8H2,1-5H3.
What are the key properties of 1,3,3-trimethyl-4-propan-2-yloxypiperidine?
1,3,3-trimethyl-4-propan-2-yloxypiperidine 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 1,3,3-trimethyl-4-propan-2-yloxypiperidine is sourced from PubChem (CID 129256143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).