3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide

C17H26N2O — CID 47195287

IUPAC3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)N1CCCC(C)C1
InChIInChI=1S/C17H26N2O/c1-12(2)15-9-5-8-14(4)16(15)18-17(20)19-10-6-7-13(3)11-19/h5,8-9,12-13H,6-7,10-11H2,1-4H3,(H,18,20)
InChIKeyIMHROQLTOFPEBP-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.38
Rot. Bonds2

About 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide

3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide (PubChem CID 47195287) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide
PubChem CID47195287
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)N1CCCC(C)C1
InChIInChI=1S/C17H26N2O/c1-12(2)15-9-5-8-14(4)16(15)18-17(20)19-10-6-7-13(3)11-19/h5,8-9,12-13H,6-7,10-11H2,1-4H3,(H,18,20)
InChIKeyIMHROQLTOFPEBP-UHFFFAOYSA-N
XLogP4.38
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-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

6-(3-methylpiperidine-1-carbonyl)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109099715
N-[2,6-di(propan-2-yl)phenyl]-2-(3-methylpiperidin-1-yl)-2-oxoacetamide
CID 108986491
(3-methylpiperidin-1-yl)-[5-(2-methyl-6-propan-2-ylanilino)-3-pyridinyl]methanone
CID 109240719
N-(3-amino-2,6-dimethylphenyl)-3-methylpiperidine-1-carboxamide
CID 79152846
2-[3-(methylamino)piperidin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 119919377
N-(2-methyl-6-propan-2-ylphenyl)-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113105948
N-[2,6-di(propan-2-yl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 2682066
3-methyl-N-(3-propan-2-ylphenyl)piperidine-1-carboxamide
CID 47199347
N-(2-methyl-6-propan-2-ylphenyl)-1-methylsulfonylpyrrolidine-2-carboxamide
CID 18093475
2-[(2-methyl-6-propan-2-ylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 5061547
4-(2-methoxyethyl)-N-(2-methyl-6-propan-2-ylphenyl)piperazine-1-carboxamide
CID 113104956
methyl 2-[(2-methyl-6-propan-2-ylphenyl)carbamoyl]pyrrolidine-1-carboxylate
CID 110754548

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide?
The IUPAC name of 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide (CID 47195287) is 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide is Cc1cccc(C(C)C)c1NC(=O)N1CCCC(C)C1.
What is the InChIKey of 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide?
The InChIKey is IMHROQLTOFPEBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12(2)15-9-5-8-14(4)16(15)18-17(20)19-10-6-7-13(3)11-19/h5,8-9,12-13H,6-7,10-11H2,1-4H3,(H,18,20).
What are the key properties of 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide?
3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methyl-6-propan-2-ylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 47195287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).