1-[2,6-di(propan-2-yl)phenyl]piperidine

C17H27N — CID 10634131

IUPAC1-[2,6-di(propan-2-yl)phenyl]piperidine
SMILESCC(C)c1cccc(C(C)C)c1N1CCCCC1
InChIInChI=1S/C17H27N/c1-13(2)15-9-8-10-16(14(3)4)17(15)18-11-6-5-7-12-18/h8-10,13-14H,5-7,11-12H2,1-4H3
InChIKeyYOKOGRJEYCVLDN-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.92
Rot. Bonds3

About 1-[2,6-di(propan-2-yl)phenyl]piperidine

1-[2,6-di(propan-2-yl)phenyl]piperidine (PubChem CID 10634131) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 1-[2,6-di(propan-2-yl)phenyl]piperidine.

Molecular Properties

Compound Name1-[2,6-di(propan-2-yl)phenyl]piperidine
PubChem CID10634131
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name1-[2,6-di(propan-2-yl)phenyl]piperidine
SMILESCC(C)c1cccc(C(C)C)c1N1CCCCC1
InChIInChI=1S/C17H27N/c1-13(2)15-9-8-10-16(14(3)4)17(15)18-11-6-5-7-12-18/h8-10,13-14H,5-7,11-12H2,1-4H3
InChIKeyYOKOGRJEYCVLDN-UHFFFAOYSA-N
XLogP4.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2,6-di(propan-2-yl)phenyl]piperidine?
The IUPAC name of 1-[2,6-di(propan-2-yl)phenyl]piperidine (CID 10634131) is 1-[2,6-di(propan-2-yl)phenyl]piperidine.
What is the SMILES notation for 1-[2,6-di(propan-2-yl)phenyl]piperidine?
The canonical SMILES for 1-[2,6-di(propan-2-yl)phenyl]piperidine is CC(C)c1cccc(C(C)C)c1N1CCCCC1.
What is the InChIKey of 1-[2,6-di(propan-2-yl)phenyl]piperidine?
The InChIKey is YOKOGRJEYCVLDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-13(2)15-9-8-10-16(14(3)4)17(15)18-11-6-5-7-12-18/h8-10,13-14H,5-7,11-12H2,1-4H3.
What are the key properties of 1-[2,6-di(propan-2-yl)phenyl]piperidine?
1-[2,6-di(propan-2-yl)phenyl]piperidine has a molecular weight of 245.41 g/mol, XLogP of 4.92, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,6-di(propan-2-yl)phenyl]piperidine is sourced from PubChem (CID 10634131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).