2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide

C15H22N2O3 — CID 113173108

IUPAC2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide
SMILESCOc1ccccc1N(CC(=O)NCC(C)C)C(C)=O
InChIInChI=1S/C15H22N2O3/c1-11(2)9-16-15(19)10-17(12(3)18)13-7-5-6-8-14(13)20-4/h5-8,11H,9-10H2,1-4H3,(H,16,19)
InChIKeyDRUVWMDALVTXEZ-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.82
Rot. Bonds6

About 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide

2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide (PubChem CID 113173108) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide
PubChem CID113173108
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide
SMILESCOc1ccccc1N(CC(=O)NCC(C)C)C(C)=O
InChIInChI=1S/C15H22N2O3/c1-11(2)9-16-15(19)10-17(12(3)18)13-7-5-6-8-14(13)20-4/h5-8,11H,9-10H2,1-4H3,(H,16,19)
InChIKeyDRUVWMDALVTXEZ-UHFFFAOYSA-N
XLogP1.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetyl-2-chloroanilino)-N-(2-methylpropyl)acetamide
CID 113171103
2-(N-acetyl-2-methoxyanilino)-N-(2-phenylethyl)acetamide
CID 113173145
2-(N-acetyl-2-methoxyanilino)-N-[(4-methoxyphenyl)methyl]acetamide
CID 113173139
2-[N-(benzenesulfonyl)-2-methoxyanilino]-N-(2-methylpropyl)acetamide
CID 3139097
2-(N-acetyl-2-methoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 113173158
2-(N-acetyl-2-methylanilino)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113167302
methyl N-[2-(N-acetyl-2-methoxyanilino)ethyl]carbamate
CID 113060483
methyl 2-[acetyl-[2-(3-methylbutylamino)-2-oxoethyl]amino]benzoate
CID 113176098
2-(N-acetyl-5-chloro-2-methoxyanilino)-N-(3-methylbutyl)acetamide
CID 113172837
2-(N-acetyl-2-chloroanilino)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113171144
2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide
CID 113168434
2-(N-methyl-2-phenoxyanilino)-N-(2-methylpropyl)acetamide
CID 56549439

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide (CID 113173108) is 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide is COc1ccccc1N(CC(=O)NCC(C)C)C(C)=O.
What is the InChIKey of 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide?
The InChIKey is DRUVWMDALVTXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-11(2)9-16-15(19)10-17(12(3)18)13-7-5-6-8-14(13)20-4/h5-8,11H,9-10H2,1-4H3,(H,16,19).
What are the key properties of 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide?
2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide has a molecular weight of 278.35 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 113173108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).