N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide

C19H22N2O2 — CID 112996467

IUPACN-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCC(=O)Nc2cc(C)ccc2C)cc1
InChIInChI=1S/C19H22N2O2/c1-13-5-8-16(9-6-13)11-18(22)20-12-19(23)21-17-10-14(2)4-7-15(17)3/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyJWXMOYRQSLPDFR-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.91
Rot. Bonds5

About N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide

N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide (PubChem CID 112996467) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
PubChem CID112996467
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCC(=O)Nc2cc(C)ccc2C)cc1
InChIInChI=1S/C19H22N2O2/c1-13-5-8-16(9-6-13)11-18(22)20-12-19(23)21-17-10-14(2)4-7-15(17)3/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyJWXMOYRQSLPDFR-UHFFFAOYSA-N
XLogP2.91
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dimethylphenyl)-2-(4-methylphenyl)acetamide
CID 889351
N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylcarbamoylamino]acetamide
CID 24604643
2-(3-bromophenyl)-N-[2-(2,5-dimethylanilino)-2-oxoethyl]acetamide
CID 112996471
N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylamino]acetamide
CID 108997079
N-(2,5-dimethylphenyl)-2-(4-sulfanylphenyl)acetamide
CID 107020877
N-(2,5-dimethylphenyl)-2-(methylamino)acetamide
CID 2396341
N-(2,5-dimethylphenyl)-2-[(4-methylphenyl)methylsulfanyl]acetamide
CID 8712604
2-[(2,5-dimethylphenyl)carbamothioylamino]-N-(2-ethylphenyl)acetamide
CID 8628442
N-[2-(2-hydroxy-4-methylanilino)-2-oxoethyl]-2-phenylacetamide
CID 9495603
N-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-2-(4-chlorophenyl)acetamide
CID 113000562
N-(2,5-dimethylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 9314105
N,4-dimethyl-3-[[2-[(2-phenylacetyl)amino]acetyl]amino]benzamide
CID 43073786

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide (CID 112996467) is N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)NCC(=O)Nc2cc(C)ccc2C)cc1.
What is the InChIKey of N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide?
The InChIKey is JWXMOYRQSLPDFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13-5-8-16(9-6-13)11-18(22)20-12-19(23)21-17-10-14(2)4-7-15(17)3/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide?
N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide has a molecular weight of 310.40 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 112996467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).