N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide

C16H24N2O — CID 60807085

IUPACN-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
SMILESCCN(C(=O)c1ccc(C)cc1C)C1CCNCC1
InChIInChI=1S/C16H24N2O/c1-4-18(14-7-9-17-10-8-14)16(19)15-6-5-12(2)11-13(15)3/h5-6,11,14,17H,4,7-10H2,1-3H3
InChIKeyFOOXFDIYYGBUCE-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.52
Rot. Bonds3

About N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide

N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide (PubChem CID 60807085) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide.

Molecular Properties

Compound NameN-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
PubChem CID60807085
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide
SMILESCCN(C(=O)c1ccc(C)cc1C)C1CCNCC1
InChIInChI=1S/C16H24N2O/c1-4-18(14-7-9-17-10-8-14)16(19)15-6-5-12(2)11-13(15)3/h5-6,11,14,17H,4,7-10H2,1-3H3
InChIKeyFOOXFDIYYGBUCE-UHFFFAOYSA-N
XLogP2.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide?
The IUPAC name of N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide (CID 60807085) is N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide.
What is the SMILES notation for N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide?
The canonical SMILES for N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide is CCN(C(=O)c1ccc(C)cc1C)C1CCNCC1.
What is the InChIKey of N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide?
The InChIKey is FOOXFDIYYGBUCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-4-18(14-7-9-17-10-8-14)16(19)15-6-5-12(2)11-13(15)3/h5-6,11,14,17H,4,7-10H2,1-3H3.
What are the key properties of N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide?
N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide has a molecular weight of 260.38 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dimethyl-N-piperidin-4-ylbenzamide is sourced from PubChem (CID 60807085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).