1-benzyl-N,2,2-trimethylpiperidin-4-amine

C15H24N2 — CID 117020178

IUPAC1-benzyl-N,2,2-trimethylpiperidin-4-amine
SMILESCNC1CCN(Cc2ccccc2)C(C)(C)C1
InChIInChI=1S/C15H24N2/c1-15(2)11-14(16-3)9-10-17(15)12-13-7-5-4-6-8-13/h4-8,14,16H,9-12H2,1-3H3
InChIKeyHXFQZEIQOVRWAN-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.65
Rot. Bonds3

About 1-benzyl-N,2,2-trimethylpiperidin-4-amine

1-benzyl-N,2,2-trimethylpiperidin-4-amine (PubChem CID 117020178) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-benzyl-N,2,2-trimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-benzyl-N,2,2-trimethylpiperidin-4-amine
PubChem CID117020178
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-benzyl-N,2,2-trimethylpiperidin-4-amine
SMILESCNC1CCN(Cc2ccccc2)C(C)(C)C1
InChIInChI=1S/C15H24N2/c1-15(2)11-14(16-3)9-10-17(15)12-13-7-5-4-6-8-13/h4-8,14,16H,9-12H2,1-3H3
InChIKeyHXFQZEIQOVRWAN-UHFFFAOYSA-N
XLogP2.65
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-2,2-dimethylpiperidine-4-carbonitrile
CID 117020253
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
(1R,5S)-2-benzyl-1-methyl-2-azabicyclo[3.1.0]hexane
CID 101450566
1-benzyl-2,2-dimethylpyrrolidine
CID 10954329
1-benzyl-2,2-dimethylpyrrolidin-3-ol
CID 83848241
1-benzyl-3-bromo-2,2-dimethylpyrrolidine
CID 130979463
3-benzyl-N,3-dimethylcyclopentan-1-amine
CID 116538980
1-benzyl-N-ethyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 20501093
1-benzyl-N-methylazetidin-2-amine
CID 57429452
2-benzyl-1-methyl-2-azabicyclo[2.1.1]hexane
CID 11389846
2-(1-benzyl-5,5-dimethylpyrrolidin-3-yl)ethanamine
CID 117018668
1-benzyl-2,2-dimethylpiperidin-4-one
CID 4070912

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N,2,2-trimethylpiperidin-4-amine?
The IUPAC name of 1-benzyl-N,2,2-trimethylpiperidin-4-amine (CID 117020178) is 1-benzyl-N,2,2-trimethylpiperidin-4-amine.
What is the SMILES notation for 1-benzyl-N,2,2-trimethylpiperidin-4-amine?
The canonical SMILES for 1-benzyl-N,2,2-trimethylpiperidin-4-amine is CNC1CCN(Cc2ccccc2)C(C)(C)C1.
What is the InChIKey of 1-benzyl-N,2,2-trimethylpiperidin-4-amine?
The InChIKey is HXFQZEIQOVRWAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-15(2)11-14(16-3)9-10-17(15)12-13-7-5-4-6-8-13/h4-8,14,16H,9-12H2,1-3H3.
What are the key properties of 1-benzyl-N,2,2-trimethylpiperidin-4-amine?
1-benzyl-N,2,2-trimethylpiperidin-4-amine has a molecular weight of 232.37 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N,2,2-trimethylpiperidin-4-amine is sourced from PubChem (CID 117020178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).