4-benzyl-3,4-diethylpiperidine

C16H25N — CID 79312303

IUPAC4-benzyl-3,4-diethylpiperidine
SMILESCCC1CNCCC1(CC)Cc1ccccc1
InChIInChI=1S/C16H25N/c1-3-15-13-17-11-10-16(15,4-2)12-14-8-6-5-7-9-14/h5-9,15,17H,3-4,10-13H2,1-2H3
InChIKeyPRDRPZDHVXIDJK-UHFFFAOYSA-N
MW231.38 g/mol
LogP3.64
Rot. Bonds4

About 4-benzyl-3,4-diethylpiperidine

4-benzyl-3,4-diethylpiperidine (PubChem CID 79312303) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 4-benzyl-3,4-diethylpiperidine.

Molecular Properties

Compound Name4-benzyl-3,4-diethylpiperidine
PubChem CID79312303
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name4-benzyl-3,4-diethylpiperidine
SMILESCCC1CNCCC1(CC)Cc1ccccc1
InChIInChI=1S/C16H25N/c1-3-15-13-17-11-10-16(15,4-2)12-14-8-6-5-7-9-14/h5-9,15,17H,3-4,10-13H2,1-2H3
InChIKeyPRDRPZDHVXIDJK-UHFFFAOYSA-N
XLogP3.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-3,4-diethylpiperidine?
The IUPAC name of 4-benzyl-3,4-diethylpiperidine (CID 79312303) is 4-benzyl-3,4-diethylpiperidine.
What is the SMILES notation for 4-benzyl-3,4-diethylpiperidine?
The canonical SMILES for 4-benzyl-3,4-diethylpiperidine is CCC1CNCCC1(CC)Cc1ccccc1.
What is the InChIKey of 4-benzyl-3,4-diethylpiperidine?
The InChIKey is PRDRPZDHVXIDJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-3-15-13-17-11-10-16(15,4-2)12-14-8-6-5-7-9-14/h5-9,15,17H,3-4,10-13H2,1-2H3.
What are the key properties of 4-benzyl-3,4-diethylpiperidine?
4-benzyl-3,4-diethylpiperidine has a molecular weight of 231.38 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-3,4-diethylpiperidine is sourced from PubChem (CID 79312303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).