N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide

C18H28N2O — CID 83198721

IUPACN-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide
SMILESCCN(C(=O)C(C)(C)C1CCCNC1)c1cccc(C)c1
InChIInChI=1S/C18H28N2O/c1-5-20(16-10-6-8-14(2)12-16)17(21)18(3,4)15-9-7-11-19-13-15/h6,8,10,12,15,19H,5,7,9,11,13H2,1-4H3
InChIKeyLJLAEXZYWZTDDB-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.37
Rot. Bonds4

About N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide

N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide (PubChem CID 83198721) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide
PubChem CID83198721
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide
SMILESCCN(C(=O)C(C)(C)C1CCCNC1)c1cccc(C)c1
InChIInChI=1S/C18H28N2O/c1-5-20(16-10-6-8-14(2)12-16)17(21)18(3,4)15-9-7-11-19-13-15/h6,8,10,12,15,19H,5,7,9,11,13H2,1-4H3
InChIKeyLJLAEXZYWZTDDB-UHFFFAOYSA-N
XLogP3.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-methyl-N-phenyl-2-piperidin-3-ylpropanamide
CID 83198421
2-methyl-1-(3-methylphenyl)-2-piperidin-3-ylpropan-1-one
CID 116611171
2,2,2-trichloro-N-ethyl-N-(3-methylphenyl)acetamide
CID 533177
N,2-dimethyl-N-phenyl-2-piperidin-3-ylpropanamide
CID 83031422
N-ethyl-N-(3-methylphenyl)-3-piperidin-4-ylpropanamide
CID 62212377
2-amino-N-ethyl-2-methyl-N-(3-methylphenyl)butanamide
CID 79805432
2-methyl-N-[2-(3-methylphenyl)ethyl]-2-piperidin-3-ylpropanamide
CID 83034566
3-(4-acetylpiperazin-1-yl)-N-ethyl-2,2-dimethyl-N-(3-methylphenyl)-3-oxopropanamide
CID 108961312
N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
N-ethyl-2,2-dimethyl-N-(3-methylphenyl)-N'-propan-2-ylpropanediamide
CID 108957363
N-(3-amino-3-oxopropyl)-N-(3-methylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119311461
N,4-diethyl-N-(3-methylphenyl)piperidine-4-carboxamide
CID 63128862

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide?
The IUPAC name of N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide (CID 83198721) is N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide.
What is the SMILES notation for N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide?
The canonical SMILES for N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide is CCN(C(=O)C(C)(C)C1CCCNC1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide?
The InChIKey is LJLAEXZYWZTDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-5-20(16-10-6-8-14(2)12-16)17(21)18(3,4)15-9-7-11-19-13-15/h6,8,10,12,15,19H,5,7,9,11,13H2,1-4H3.
What are the key properties of N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide?
N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide has a molecular weight of 288.44 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-N-(3-methylphenyl)-2-piperidin-3-ylpropanamide is sourced from PubChem (CID 83198721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).