2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine

C17H28N2 — CID 115145488

IUPAC2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine
SMILESCc1cc(C)c(CNC2CCNC(C)(C)C2)c(C)c1
InChIInChI=1S/C17H28N2/c1-12-8-13(2)16(14(3)9-12)11-18-15-6-7-19-17(4,5)10-15/h8-9,15,18-19H,6-7,10-11H2,1-5H3
InChIKeyQGOBHKRGLWWISB-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.23
Rot. Bonds3

About 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine

2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine (PubChem CID 115145488) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine
PubChem CID115145488
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine
SMILESCc1cc(C)c(CNC2CCNC(C)(C)C2)c(C)c1
InChIInChI=1S/C17H28N2/c1-12-8-13(2)16(14(3)9-12)11-18-15-6-7-19-17(4,5)10-15/h8-9,15,18-19H,6-7,10-11H2,1-5H3
InChIKeyQGOBHKRGLWWISB-UHFFFAOYSA-N
XLogP3.23
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,3-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-amine
CID 114544213
5,5-dimethyl-N-[(2,3,5,6-tetramethylphenyl)methyl]pyrrolidin-3-amine
CID 115145890
N-[(2,4,6-trimethylphenyl)methyl]cyclohexanamine
CID 43082188
4-ethyl-N-[(2,4,6-trimethylphenyl)methyl]cyclohexan-1-amine
CID 63453897
(5S,9R)-N-[(2,4,6-trimethylphenyl)methyl]-2,6-dioxaspiro[4.5]decan-9-amine
CID 97255391
1,1-dioxo-N-[(2,4,6-trimethylphenyl)methyl]thian-4-amine
CID 43614931
N-(1H-indol-3-ylmethyl)-2,2-dimethylpiperidin-4-amine
CID 115145493
2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-amine
CID 79861537
3,3,7-trimethyl-1-[(2,4,6-trimethylphenyl)methyl]-1,4-diazepane
CID 64871985
N-[2-(4-fluorophenyl)ethyl]-2,2-dimethylpiperidin-4-amine
CID 115145574
2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]cyclohexan-1-amine
CID 79861658
N-(2-cyclopentyl-2-methylpropyl)-2,2-dimethylpiperidin-4-amine
CID 115145654

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine?
The IUPAC name of 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine (CID 115145488) is 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine?
The canonical SMILES for 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine is Cc1cc(C)c(CNC2CCNC(C)(C)C2)c(C)c1.
What is the InChIKey of 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine?
The InChIKey is QGOBHKRGLWWISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-12-8-13(2)16(14(3)9-12)11-18-15-6-7-19-17(4,5)10-15/h8-9,15,18-19H,6-7,10-11H2,1-5H3.
What are the key properties of 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine?
2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine has a molecular weight of 260.43 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(2,4,6-trimethylphenyl)methyl]piperidin-4-amine is sourced from PubChem (CID 115145488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).