N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide

C18H28N2O2 — CID 112997279

IUPACN-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide
SMILESCCc1cccc(CC)c1NC(=O)CNC(=O)C(CC)CC
InChIInChI=1S/C18H28N2O2/c1-5-13(6-2)18(22)19-12-16(21)20-17-14(7-3)10-9-11-15(17)8-4/h9-11,13H,5-8,12H2,1-4H3,(H,19,22)(H,20,21)
InChIKeyUOJXZTJKTBCERH-UHFFFAOYSA-N
MW304.43 g/mol
LogP3.30
Rot. Bonds8

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

N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide (PubChem CID 112997279) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide.

Molecular Properties

Compound NameN-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide
PubChem CID112997279
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC NameN-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide
SMILESCCc1cccc(CC)c1NC(=O)CNC(=O)C(CC)CC
InChIInChI=1S/C18H28N2O2/c1-5-13(6-2)18(22)19-12-16(21)20-17-14(7-3)10-9-11-15(17)8-4/h9-11,13H,5-8,12H2,1-4H3,(H,19,22)(H,20,21)
InChIKeyUOJXZTJKTBCERH-UHFFFAOYSA-N
XLogP3.30
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-[2-(2,6-diethylanilino)-2-oxoethyl]benzamide
CID 112997289
N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-2-phenylacetamide
CID 112997001
tert-butyl N-[2-(2,6-diethylanilino)-2-oxoethyl]carbamate
CID 112997331
N-[2-(2,6-diethylanilino)-2-oxoethyl]-3-fluorobenzamide
CID 112997286
N-(2,6-diethylphenyl)-2-(2,6-difluoroanilino)acetamide
CID 109008077
2-(benzhydrylamino)-N-(2,6-diethylphenyl)acetamide
CID 2620925
N-[2-[4-(dimethylamino)anilino]-2-oxoethyl]-2-ethylbutanamide
CID 110407235
N-(2,6-diethylphenyl)-2-[ethyl(methyl)amino]acetamide
CID 60516664
N-[2-[2,6-di(propan-2-yl)anilino]-2-oxoethyl]-2-methylpropanamide
CID 113000636
N-(2,6-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004349
2-ethyl-N-[2-oxo-2-(1-phenylethylamino)ethyl]butanamide
CID 112992317
2-ethyl-N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]butanamide
CID 112999463

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide?
The IUPAC name of N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide (CID 112997279) is N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide.
What is the SMILES notation for N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide?
The canonical SMILES for N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide is CCc1cccc(CC)c1NC(=O)CNC(=O)C(CC)CC.
What is the InChIKey of N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide?
The InChIKey is UOJXZTJKTBCERH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-5-13(6-2)18(22)19-12-16(21)20-17-14(7-3)10-9-11-15(17)8-4/h9-11,13H,5-8,12H2,1-4H3,(H,19,22)(H,20,21).
What are the key properties of N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide?
N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide has a molecular weight of 304.43 g/mol, XLogP of 3.30, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-diethylanilino)-2-oxoethyl]-2-ethylbutanamide is sourced from PubChem (CID 112997279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).