N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide

C17H26N2O — CID 110858395

IUPACN-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide
SMILESCN1CCCCC1C(=O)Nc1ccccc1C(C)(C)C
InChIInChI=1S/C17H26N2O/c1-17(2,3)13-9-5-6-10-14(13)18-16(20)15-11-7-8-12-19(15)4/h5-6,9-10,15H,7-8,11-12H2,1-4H3,(H,18,20)
InChIKeySCZIHLVFMUZPNL-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.41
Rot. Bonds2

About N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide

N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide (PubChem CID 110858395) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide
PubChem CID110858395
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide
SMILESCN1CCCCC1C(=O)Nc1ccccc1C(C)(C)C
InChIInChI=1S/C17H26N2O/c1-17(2,3)13-9-5-6-10-14(13)18-16(20)15-11-7-8-12-19(15)4/h5-6,9-10,15H,7-8,11-12H2,1-4H3,(H,18,20)
InChIKeySCZIHLVFMUZPNL-UHFFFAOYSA-N
XLogP3.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-tert-butylphenyl)-1-methylpiperidine-2-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

N-(2-tert-butylphenyl)cyclopentanecarboxamide
CID 7688669
N-(2-tert-butylphenyl)-1-methylpiperidine-4-carboxamide
CID 110693521
1-acetyl-N-(2-tert-butylphenyl)piperidine-4-carboxamide
CID 110686050
2-[(2-tert-butylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 22688945
1-acetyl-N-(2-tert-butylphenyl)piperidine-3-carboxamide
CID 110686139
1-N-(2-tert-butylphenyl)-4-N-propan-2-ylcyclohexane-1,4-dicarboxamide
CID 109144561
1-N-tert-butyl-2-N-(2-tert-butylphenyl)cyclopropane-1,2-dicarboxamide
CID 109139608
N-(2,6-difluorophenyl)-1-methylpiperidine-2-carboxamide
CID 110865260
(2S)-N-(2,6-dimethylphenyl)-1-methylpiperidine-2-carboxamide;hydrochloride
CID 66586222
(2R)-N-(2-tert-butylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119399894
1-methyl-N-[4-(trifluoromethyl)phenyl]piperidine-2-carboxamide
CID 110860923
N-[2-(2-tert-butylanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112997525

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide?
The IUPAC name of N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide (CID 110858395) is N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide is CN1CCCCC1C(=O)Nc1ccccc1C(C)(C)C.
What is the InChIKey of N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide?
The InChIKey is SCZIHLVFMUZPNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-17(2,3)13-9-5-6-10-14(13)18-16(20)15-11-7-8-12-19(15)4/h5-6,9-10,15H,7-8,11-12H2,1-4H3,(H,18,20).
What are the key properties of N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide?
N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide is sourced from PubChem (CID 110858395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).