N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide

C17H26N2O — CID 119318660

IUPACN-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide
SMILESCc1ccc(C(C)(C)CNC(=O)C2CCCCN2)cc1
InChIInChI=1S/C17H26N2O/c1-13-7-9-14(10-8-13)17(2,3)12-19-16(20)15-6-4-5-11-18-15/h7-10,15,18H,4-6,11-12H2,1-3H3,(H,19,20)
InChIKeyVTKMPRFKOPFGGZ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.53
Rot. Bonds4

About N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide

N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide (PubChem CID 119318660) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide
PubChem CID119318660
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide
SMILESCc1ccc(C(C)(C)CNC(=O)C2CCCCN2)cc1
InChIInChI=1S/C17H26N2O/c1-13-7-9-14(10-8-13)17(2,3)12-19-16(20)15-6-4-5-11-18-15/h7-10,15,18H,4-6,11-12H2,1-3H3,(H,19,20)
InChIKeyVTKMPRFKOPFGGZ-UHFFFAOYSA-N
XLogP2.53
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-chlorophenyl)-2-methylpropyl]piperidine-2-carboxamide
CID 119297349
(2S)-N-(2-methyl-2-phenylpropyl)piperidine-2-carboxamide
CID 93398876
(2R)-N-(2-methyl-2-phenylpropyl)piperidine-2-carboxamide;hydrochloride
CID 119724295
N-[2-(4-bromophenyl)-2-methylpropyl]pyrrolidine-2-carboxamide
CID 115159331
N-[2-methyl-2-[3-(trifluoromethyl)phenyl]propyl]piperidine-2-carboxamide;hydrochloride
CID 119316485
N-[2-methyl-2-(5-methylfuran-2-yl)propyl]piperidine-2-carboxamide
CID 115159844
N-[2-methyl-2-(4-methylphenyl)propyl]-2-pyrrolidin-2-ylacetamide
CID 119775261
N-[2-(3-chlorophenyl)-2-methylpropyl]pyrrolidine-2-carboxamide
CID 110461441
N-[(4-tert-butylphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119280628
N-[2-(3-bromophenyl)-2-methylpropyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119314229
N-[2-methyl-2-(4-methylphenyl)propyl]azetidine-3-carboxamide
CID 115159125
N-[2-(4-methylphenoxy)ethyl]piperidine-2-carboxamide
CID 119266821

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide?
The IUPAC name of N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide (CID 119318660) is N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide?
The canonical SMILES for N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide is Cc1ccc(C(C)(C)CNC(=O)C2CCCCN2)cc1.
What is the InChIKey of N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide?
The InChIKey is VTKMPRFKOPFGGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13-7-9-14(10-8-13)17(2,3)12-19-16(20)15-6-4-5-11-18-15/h7-10,15,18H,4-6,11-12H2,1-3H3,(H,19,20).
What are the key properties of N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide?
N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 2.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-2-(4-methylphenyl)propyl]piperidine-2-carboxamide is sourced from PubChem (CID 119318660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).