2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide

C17H28N2O — CID 62328197

IUPAC2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide
SMILESCCc1cccc(CC)c1NCC(=O)NC(C)C(C)C
InChIInChI=1S/C17H28N2O/c1-6-14-9-8-10-15(7-2)17(14)18-11-16(20)19-13(5)12(3)4/h8-10,12-13,18H,6-7,11H2,1-5H3,(H,19,20)
InChIKeyATQGMMYLCVOWBJ-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.38
Rot. Bonds7

About 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide

2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide (PubChem CID 62328197) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide
PubChem CID62328197
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide
SMILESCCc1cccc(CC)c1NCC(=O)NC(C)C(C)C
InChIInChI=1S/C17H28N2O/c1-6-14-9-8-10-15(7-2)17(14)18-11-16(20)19-13(5)12(3)4/h8-10,12-13,18H,6-7,11H2,1-5H3,(H,19,20)
InChIKeyATQGMMYLCVOWBJ-UHFFFAOYSA-N
XLogP3.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-diethylanilino)-N-(1-methoxypropan-2-yl)acetamide
CID 62328026
2-(2,6-diethylanilino)acetohydrazide
CID 13014243
2-(2,6-diethylanilino)-N-(3-methylbutyl)acetamide
CID 62327341
2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 60688155
2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 99626723
N-(2,6-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004349
2-(2,3-dimethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 60683498
2-(2,6-diethylanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 109008014
N-(2,6-diethylphenyl)-2-(2,6-difluoroanilino)acetamide
CID 109008077
2-(2,6-diethylanilino)-N-[2-(dimethylamino)ethyl]acetamide
CID 108994657
2-(2,6-diethylanilino)-N-(2-phenylethyl)acetamide
CID 108999995
2-(2-fluorophenyl)-N-(3-methylbutan-2-yl)acetamide
CID 78799919

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide (CID 62328197) is 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide is CCc1cccc(CC)c1NCC(=O)NC(C)C(C)C.
What is the InChIKey of 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is ATQGMMYLCVOWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-6-14-9-8-10-15(7-2)17(14)18-11-16(20)19-13(5)12(3)4/h8-10,12-13,18H,6-7,11H2,1-5H3,(H,19,20).
What are the key properties of 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide?
2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 276.42 g/mol, XLogP of 3.38, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 62328197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).