2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide

C14H20N2O3 — CID 113173486

IUPAC2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide
SMILESCOc1ccc(N(CC(=O)NC(C)C)C(C)=O)cc1
InChIInChI=1S/C14H20N2O3/c1-10(2)15-14(18)9-16(11(3)17)12-5-7-13(19-4)8-6-12/h5-8,10H,9H2,1-4H3,(H,15,18)
InChIKeySTDQTYCRUVJSDC-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.57
Rot. Bonds5

About 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide

2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide (PubChem CID 113173486) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide
PubChem CID113173486
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide
SMILESCOc1ccc(N(CC(=O)NC(C)C)C(C)=O)cc1
InChIInChI=1S/C14H20N2O3/c1-10(2)15-14(18)9-16(11(3)17)12-5-7-13(19-4)8-6-12/h5-8,10H,9H2,1-4H3,(H,15,18)
InChIKeySTDQTYCRUVJSDC-UHFFFAOYSA-N
XLogP1.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-acetyl-4-methoxyanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113173591
2-[N-acetyl-4-(dimethylamino)anilino]-N-(4-methoxyphenyl)acetamide
CID 113176766
2-(N-acetyl-4-methoxyanilino)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 113173533
2-(N-acetyl-4-methoxyanilino)-N-pentylacetamide
CID 113173563
2-(N-acetyl-4-propan-2-yloxyanilino)-N-butan-2-ylacetamide
CID 113174353
N-ethyl-4-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 47105894
2-(N-acetyl-4-methoxyanilino)-N-(3,5-dichlorophenyl)acetamide
CID 113173660
2-(N-acetyl-4-ethylanilino)-N-[(4-methoxyphenyl)methyl]acetamide
CID 113169241
2-(4-methoxyphenyl)-N-propan-2-ylacetamide
CID 813075
2-[[1-(4-methoxyphenyl)-1-oxopropan-2-yl]-methylamino]-N-propan-2-ylacetamide
CID 60681805
3-(N-acetyl-3,4-dimethoxyanilino)-N-propan-2-ylpropanamide
CID 113130179
methyl 2-(N-acetyl-4-acetyloxyanilino)acetate
CID 22630317

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide?
The IUPAC name of 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide (CID 113173486) is 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide is COc1ccc(N(CC(=O)NC(C)C)C(C)=O)cc1.
What is the InChIKey of 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide?
The InChIKey is STDQTYCRUVJSDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10(2)15-14(18)9-16(11(3)17)12-5-7-13(19-4)8-6-12/h5-8,10H,9H2,1-4H3,(H,15,18).
What are the key properties of 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide?
2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide has a molecular weight of 264.32 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-methoxyanilino)-N-propan-2-ylacetamide is sourced from PubChem (CID 113173486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).