N-ethyl-2-(2-methylphenyl)-N-phenylacetamide

C17H19NO — CID 113098481

IUPACN-ethyl-2-(2-methylphenyl)-N-phenylacetamide
SMILESCCN(C(=O)Cc1ccccc1C)c1ccccc1
InChIInChI=1S/C17H19NO/c1-3-18(16-11-5-4-6-12-16)17(19)13-15-10-8-7-9-14(15)2/h4-12H,3,13H2,1-2H3
InChIKeyKHRMFJPIQNOBGH-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.59
Rot. Bonds4

About N-ethyl-2-(2-methylphenyl)-N-phenylacetamide

N-ethyl-2-(2-methylphenyl)-N-phenylacetamide (PubChem CID 113098481) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is N-ethyl-2-(2-methylphenyl)-N-phenylacetamide.

Molecular Properties

Compound NameN-ethyl-2-(2-methylphenyl)-N-phenylacetamide
PubChem CID113098481
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC NameN-ethyl-2-(2-methylphenyl)-N-phenylacetamide
SMILESCCN(C(=O)Cc1ccccc1C)c1ccccc1
InChIInChI=1S/C17H19NO/c1-3-18(16-11-5-4-6-12-16)17(19)13-15-10-8-7-9-14(15)2/h4-12H,3,13H2,1-2H3
InChIKeyKHRMFJPIQNOBGH-UHFFFAOYSA-N
XLogP3.59
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-methylphenyl)-N-phenylacetamide?
The IUPAC name of N-ethyl-2-(2-methylphenyl)-N-phenylacetamide (CID 113098481) is N-ethyl-2-(2-methylphenyl)-N-phenylacetamide.
What is the SMILES notation for N-ethyl-2-(2-methylphenyl)-N-phenylacetamide?
The canonical SMILES for N-ethyl-2-(2-methylphenyl)-N-phenylacetamide is CCN(C(=O)Cc1ccccc1C)c1ccccc1.
What is the InChIKey of N-ethyl-2-(2-methylphenyl)-N-phenylacetamide?
The InChIKey is KHRMFJPIQNOBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-3-18(16-11-5-4-6-12-16)17(19)13-15-10-8-7-9-14(15)2/h4-12H,3,13H2,1-2H3.
What are the key properties of N-ethyl-2-(2-methylphenyl)-N-phenylacetamide?
N-ethyl-2-(2-methylphenyl)-N-phenylacetamide has a molecular weight of 253.35 g/mol, XLogP of 3.59, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-methylphenyl)-N-phenylacetamide is sourced from PubChem (CID 113098481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).