N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide

C18H21NO — CID 55592045

IUPACN-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide
SMILESCCN(C(=O)Cc1ccccc1)c1cc(C)cc(C)c1
InChIInChI=1S/C18H21NO/c1-4-19(17-11-14(2)10-15(3)12-17)18(20)13-16-8-6-5-7-9-16/h5-12H,4,13H2,1-3H3
InChIKeyXHAILJXGFGZEHF-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.90
Rot. Bonds4

About N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide

N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide (PubChem CID 55592045) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide
PubChem CID55592045
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide
SMILESCCN(C(=O)Cc1ccccc1)c1cc(C)cc(C)c1
InChIInChI=1S/C18H21NO/c1-4-19(17-11-14(2)10-15(3)12-17)18(20)13-16-8-6-5-7-9-16/h5-12H,4,13H2,1-3H3
InChIKeyXHAILJXGFGZEHF-UHFFFAOYSA-N
XLogP3.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,5-dimethylphenyl)-N-ethyl-3-phenylpropanamide
CID 52574490
N-(3,5-dimethylphenyl)-N-ethylbenzamide
CID 52574489
N-ethyl-N,2-bis(3-methylphenyl)acetamide
CID 113099036
N-(4-aminophenyl)-N-ethyl-2-(3-methylphenyl)acetamide
CID 63234126
3-(2-aminophenyl)-N-(3,5-dimethylphenyl)-N-ethylpropanamide
CID 120609604
2-(3-bromophenyl)-N-ethyl-N-phenylacetamide
CID 113098483
N-ethyl-3,5-dimethyl-N-phenylbenzamide
CID 134028664
N-(2-aminoethyl)-N-(3-methylphenyl)-2-phenylacetamide
CID 28768817
N-(5-amino-2-pyridinyl)-N-ethyl-2-phenylacetamide
CID 115268143
N-ethyl-2-(2-methylphenyl)-N-phenylacetamide
CID 113098481
N-ethyl-N-(2-methylphenyl)-2-(4-methylphenyl)acetamide
CID 3610846
N-ethyl-N,2-bis(3-hydroxyphenyl)acetamide
CID 107735678

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide (CID 55592045) is N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide is CCN(C(=O)Cc1ccccc1)c1cc(C)cc(C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide?
The InChIKey is XHAILJXGFGZEHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-4-19(17-11-14(2)10-15(3)12-17)18(20)13-16-8-6-5-7-9-16/h5-12H,4,13H2,1-3H3.
What are the key properties of N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide?
N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide has a molecular weight of 267.37 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide is sourced from PubChem (CID 55592045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).