N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine

C17H28N2 — CID 43693262

IUPACN-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine
SMILESCN1CCC(NC(c2ccccc2)C(C)(C)C)CC1
InChIInChI=1S/C17H28N2/c1-17(2,3)16(14-8-6-5-7-9-14)18-15-10-12-19(4)13-11-15/h5-9,15-16,18H,10-13H2,1-4H3
InChIKeyXUBXTFAKNHFTKS-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.46
Rot. Bonds3

About N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine

N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine (PubChem CID 43693262) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine
PubChem CID43693262
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC NameN-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine
SMILESCN1CCC(NC(c2ccccc2)C(C)(C)C)CC1
InChIInChI=1S/C17H28N2/c1-17(2,3)16(14-8-6-5-7-9-14)18-15-10-12-19(4)13-11-15/h5-9,15-16,18H,10-13H2,1-4H3
InChIKeyXUBXTFAKNHFTKS-UHFFFAOYSA-N
XLogP3.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-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

1-[4-[(2,2-dimethyl-1-phenylpropyl)amino]piperidin-1-yl]ethanone
CID 43783246
N-benzhydryl-1-methylpiperidin-4-amine;dihydrochloride
CID 134094585
1-methyl-N-[(1S)-1-phenylethyl]azepan-4-amine
CID 81350289
N-(2,2-dimethyl-1-phenylpropyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82853453
1-methyl-N-(3-methyl-1-phenylbutyl)piperidin-4-amine
CID 43216052
N-(2,2-dimethyl-1-phenylpropyl)-3,3-dimethylcyclopentan-1-amine
CID 80705631
(3S)-1-methyl-N-(1-phenylethyl)pyrrolidin-3-amine
CID 134939795
1-methyl-N-[phenyl(thiophen-2-yl)methyl]piperidin-4-amine
CID 43224396
N-(2,2-dimethyl-1-phenylpropyl)-1,2,5-trimethylpiperidin-4-amine
CID 43693331
1-methyl-N-[(1-methylbenzimidazol-2-yl)-phenylmethyl]piperidin-4-amine
CID 75383078
N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine
CID 126609529
N-(1-cyclopropylethyl)-2,2-dimethyl-1-phenylpropan-1-amine
CID 43693312

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine?
The IUPAC name of N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine (CID 43693262) is N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine.
What is the SMILES notation for N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine?
The canonical SMILES for N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine is CN1CCC(NC(c2ccccc2)C(C)(C)C)CC1.
What is the InChIKey of N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine?
The InChIKey is XUBXTFAKNHFTKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-17(2,3)16(14-8-6-5-7-9-14)18-15-10-12-19(4)13-11-15/h5-9,15-16,18H,10-13H2,1-4H3.
What are the key properties of N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine?
N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine has a molecular weight of 260.43 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-1-phenylpropyl)-1-methylpiperidin-4-amine is sourced from PubChem (CID 43693262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).