N-[2-(N,4-diacetylanilino)ethyl]acetamide

C14H18N2O3 — CID 113061629

IUPACN-[2-(N,4-diacetylanilino)ethyl]acetamide
SMILESCC(=O)NCCN(C(C)=O)c1ccc(C(C)=O)cc1
InChIInChI=1S/C14H18N2O3/c1-10(17)13-4-6-14(7-5-13)16(12(3)19)9-8-15-11(2)18/h4-7H,8-9H2,1-3H3,(H,15,18)
InChIKeyVMPQQITZALSEAK-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.38
Rot. Bonds5

About N-[2-(N,4-diacetylanilino)ethyl]acetamide

N-[2-(N,4-diacetylanilino)ethyl]acetamide (PubChem CID 113061629) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-[2-(N,4-diacetylanilino)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(N,4-diacetylanilino)ethyl]acetamide
PubChem CID113061629
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-[2-(N,4-diacetylanilino)ethyl]acetamide
SMILESCC(=O)NCCN(C(C)=O)c1ccc(C(C)=O)cc1
InChIInChI=1S/C14H18N2O3/c1-10(17)13-4-6-14(7-5-13)16(12(3)19)9-8-15-11(2)18/h4-7H,8-9H2,1-3H3,(H,15,18)
InChIKeyVMPQQITZALSEAK-UHFFFAOYSA-N
XLogP1.38
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(N-acetyl-4-fluoroanilino)ethyl]acetamide
CID 113059276
N-[2-(N,4-diacetylanilino)ethyl]-4-fluorobenzamide
CID 113061648
ethyl N-[2-(N,4-diacetylanilino)ethyl]carbamate
CID 113061688
ethyl 4-[2-acetamidoethyl(acetyl)amino]benzoate
CID 113063225
N-[2-(N,4-diacetylanilino)ethyl]-3-methylbutanamide
CID 113061635
N-[2-(N-acetyl-4-methoxyanilino)ethyl]acetamide
CID 91715659
N-(4-acetylphenyl)-N-[2-(methanesulfonamido)ethyl]acetamide
CID 113061694
N-[2-(N,4-diacetylanilino)ethyl]-4-(trifluoromethyl)benzamide
CID 113061679
N-[2-(N,4-diacetylanilino)ethyl]cyclobutanecarboxamide
CID 113061690
N-[2-(N-acetyl-3,4-dimethylanilino)ethyl]acetamide
CID 113057862
N-(4-acetylphenyl)-N-[2-(cyclohexylcarbamoylamino)ethyl]acetamide
CID 113061686
N-[2-(N,4-diacetylanilino)ethyl]-2-(3-methylphenyl)acetamide
CID 113061683

Frequently Asked Questions

What is the IUPAC name of N-[2-(N,4-diacetylanilino)ethyl]acetamide?
The IUPAC name of N-[2-(N,4-diacetylanilino)ethyl]acetamide (CID 113061629) is N-[2-(N,4-diacetylanilino)ethyl]acetamide.
What is the SMILES notation for N-[2-(N,4-diacetylanilino)ethyl]acetamide?
The canonical SMILES for N-[2-(N,4-diacetylanilino)ethyl]acetamide is CC(=O)NCCN(C(C)=O)c1ccc(C(C)=O)cc1.
What is the InChIKey of N-[2-(N,4-diacetylanilino)ethyl]acetamide?
The InChIKey is VMPQQITZALSEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-10(17)13-4-6-14(7-5-13)16(12(3)19)9-8-15-11(2)18/h4-7H,8-9H2,1-3H3,(H,15,18).
What are the key properties of N-[2-(N,4-diacetylanilino)ethyl]acetamide?
N-[2-(N,4-diacetylanilino)ethyl]acetamide has a molecular weight of 262.31 g/mol, XLogP of 1.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N,4-diacetylanilino)ethyl]acetamide is sourced from PubChem (CID 113061629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).