N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide

C20H32N2O2 — CID 113058866

IUPACN-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide
SMILESCCc1cccc(CC)c1N(CCNC(=O)C(CC)CC)C(C)=O
InChIInChI=1S/C20H32N2O2/c1-6-16(7-2)20(24)21-13-14-22(15(5)23)19-17(8-3)11-10-12-18(19)9-4/h10-12,16H,6-9,13-14H2,1-5H3,(H,21,24)
InChIKeyGDNMBLPAJQSVOK-UHFFFAOYSA-N
MW332.49 g/mol
LogP3.72
Rot. Bonds9

About N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide

N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide (PubChem CID 113058866) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide.

Molecular Properties

Compound NameN-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide
PubChem CID113058866
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC NameN-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide
SMILESCCc1cccc(CC)c1N(CCNC(=O)C(CC)CC)C(C)=O
InChIInChI=1S/C20H32N2O2/c1-6-16(7-2)20(24)21-13-14-22(15(5)23)19-17(8-3)11-10-12-18(19)9-4/h10-12,16H,6-9,13-14H2,1-5H3,(H,21,24)
InChIKeyGDNMBLPAJQSVOK-UHFFFAOYSA-N
XLogP3.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-(2-methylphenyl)acetamide
CID 113058904
N-[2-(N-acetylanilino)ethyl]-2-ethylbutanamide
CID 113057161
N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-(4-chlorophenyl)acetamide
CID 113058887
N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-4-fluorobenzamide
CID 113058875
N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-(3-methylphenyl)acetamide
CID 113058905
N-(2,6-diethylphenyl)-N-[2-(ethylsulfonylamino)ethyl]acetamide
CID 113058917
N-[2-(N-acetyl-2-ethyl-6-methylanilino)ethyl]-4-methylbenzamide
CID 113058508
N-[2-(N-acetyl-4-bromo-2-methylanilino)ethyl]-2-ethylbutanamide
CID 113062870
N-[2-[acetyl-[(3-methylphenyl)methyl]amino]ethyl]-2-ethylbutanamide
CID 113054219
N-[2-(N-acetyl-2-ethylanilino)ethyl]-2-phenylacetamide
CID 113058316
N-[2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]ethyl]-2-ethylbutanamide
CID 113063034
N-[2-[N-acetyl-2,6-di(propan-2-yl)anilino]ethyl]-2-(2-methylphenyl)acetamide
CID 113063126

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide?
The IUPAC name of N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide (CID 113058866) is N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide.
What is the SMILES notation for N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide?
The canonical SMILES for N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide is CCc1cccc(CC)c1N(CCNC(=O)C(CC)CC)C(C)=O.
What is the InChIKey of N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide?
The InChIKey is GDNMBLPAJQSVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-6-16(7-2)20(24)21-13-14-22(15(5)23)19-17(8-3)11-10-12-18(19)9-4/h10-12,16H,6-9,13-14H2,1-5H3,(H,21,24).
What are the key properties of N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide?
N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide has a molecular weight of 332.49 g/mol, XLogP of 3.72, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-ethylbutanamide is sourced from PubChem (CID 113058866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).