N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide

C18H28N2O — CID 106738996

IUPACN-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide
SMILESCC1CC(C(=O)NC(c2ccccc2)C(C)(C)C)CCN1
InChIInChI=1S/C18H28N2O/c1-13-12-15(10-11-19-13)17(21)20-16(18(2,3)4)14-8-6-5-7-9-14/h5-9,13,15-16,19H,10-12H2,1-4H3,(H,20,21)
InChIKeyQYOGSOLGECEBCS-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.28
Rot. Bonds3

About N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide

N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide (PubChem CID 106738996) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide
PubChem CID106738996
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide
SMILESCC1CC(C(=O)NC(c2ccccc2)C(C)(C)C)CCN1
InChIInChI=1S/C18H28N2O/c1-13-12-15(10-11-19-13)17(21)20-16(18(2,3)4)14-8-6-5-7-9-14/h5-9,13,15-16,19H,10-12H2,1-4H3,(H,20,21)
InChIKeyQYOGSOLGECEBCS-UHFFFAOYSA-N
XLogP3.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide 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

2-methyl-N-(2-methyl-1-phenylpropyl)piperidine-4-carboxamide
CID 106738958
2-methyl-N-(1-phenylethyl)piperidine-4-carboxamide
CID 106738514
N-(2,2-dimethyl-1-phenylpropyl)-4-methylpiperidine-2-carboxamide
CID 114423032
(2S,4S)-N-[(3-chlorophenyl)-phenylmethyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120623965
(2S,4S)-N-[(3-chlorophenyl)-phenylmethyl]-2-methylpiperidine-4-carboxamide
CID 120623966
(2S,4S)-N-[cyclopentyl(phenyl)methyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120624090
(2S,4S)-2-methyl-N-(3-methyl-1-phenylbutyl)piperidine-4-carboxamide;hydrochloride
CID 120618230
(2S,4S)-2-methyl-N-[phenyl(pyridin-4-yl)methyl]piperidine-4-carboxamide
CID 120634235
(2S,4S)-N-[furan-2-yl(phenyl)methyl]-2-methylpiperidine-4-carboxamide
CID 120631631
3-amino-N-(2,2-dimethyl-1-phenylpropyl)cyclohexane-1-carboxamide
CID 63043944
N-[(1S)-1-(3-fluorophenyl)ethyl]-2-methylpiperidine-4-carboxamide
CID 106740405
(2S,4S)-N-[1-(3-benzamidophenyl)ethyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120620755

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide?
The IUPAC name of N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide (CID 106738996) is N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide is CC1CC(C(=O)NC(c2ccccc2)C(C)(C)C)CCN1.
What is the InChIKey of N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide?
The InChIKey is QYOGSOLGECEBCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-13-12-15(10-11-19-13)17(21)20-16(18(2,3)4)14-8-6-5-7-9-14/h5-9,13,15-16,19H,10-12H2,1-4H3,(H,20,21).
What are the key properties of N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide?
N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide has a molecular weight of 288.44 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-1-phenylpropyl)-2-methylpiperidine-4-carboxamide is sourced from PubChem (CID 106738996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).