4-tert-butyl-1,2-dimethylpiperidine

C11H23N — CID 89116342

IUPAC4-tert-butyl-1,2-dimethylpiperidine
SMILESCC1CC(C(C)(C)C)CCN1C
InChIInChI=1S/C11H23N/c1-9-8-10(11(2,3)4)6-7-12(9)5/h9-10H,6-8H2,1-5H3
InChIKeyOFTYMEGITFEXIP-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.76
Rot. Bonds

About 4-tert-butyl-1,2-dimethylpiperidine

4-tert-butyl-1,2-dimethylpiperidine (PubChem CID 89116342) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 4-tert-butyl-1,2-dimethylpiperidine.

Molecular Properties

Compound Name4-tert-butyl-1,2-dimethylpiperidine
PubChem CID89116342
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name4-tert-butyl-1,2-dimethylpiperidine
SMILESCC1CC(C(C)(C)C)CCN1C
InChIInChI=1S/C11H23N/c1-9-8-10(11(2,3)4)6-7-12(9)5/h9-10H,6-8H2,1-5H3
InChIKeyOFTYMEGITFEXIP-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-1,2-dimethylpiperidine?
The IUPAC name of 4-tert-butyl-1,2-dimethylpiperidine (CID 89116342) is 4-tert-butyl-1,2-dimethylpiperidine.
What is the SMILES notation for 4-tert-butyl-1,2-dimethylpiperidine?
The canonical SMILES for 4-tert-butyl-1,2-dimethylpiperidine is CC1CC(C(C)(C)C)CCN1C.
What is the InChIKey of 4-tert-butyl-1,2-dimethylpiperidine?
The InChIKey is OFTYMEGITFEXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9-8-10(11(2,3)4)6-7-12(9)5/h9-10H,6-8H2,1-5H3.
What are the key properties of 4-tert-butyl-1,2-dimethylpiperidine?
4-tert-butyl-1,2-dimethylpiperidine has a molecular weight of 169.31 g/mol, XLogP of 2.76, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-1,2-dimethylpiperidine is sourced from PubChem (CID 89116342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).