2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide

C15H24N2O — CID 60688155

IUPAC2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide
SMILESCCc1cccc(NCC(=O)NC(C)C(C)C)c1
InChIInChI=1S/C15H24N2O/c1-5-13-7-6-8-14(9-13)16-10-15(18)17-12(4)11(2)3/h6-9,11-12,16H,5,10H2,1-4H3,(H,17,18)
InChIKeyMUFCUVOUSUBVEE-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.82
Rot. Bonds6

About 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide

2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide (PubChem CID 60688155) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide
PubChem CID60688155
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide
SMILESCCc1cccc(NCC(=O)NC(C)C(C)C)c1
InChIInChI=1S/C15H24N2O/c1-5-13-7-6-8-14(9-13)16-10-15(18)17-12(4)11(2)3/h6-9,11-12,16H,5,10H2,1-4H3,(H,17,18)
InChIKeyMUFCUVOUSUBVEE-UHFFFAOYSA-N
XLogP2.82
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethylanilino)-N-propan-2-ylacetamide
CID 28584308
2-(3-ethylanilino)-N-pentan-2-ylacetamide
CID 60688098
2-(3-ethylanilino)-N-(3-methylbutyl)acetamide
CID 60672205
2-[3-(dimethylamino)anilino]-N-(3-methylbutan-2-yl)acetamide
CID 78914085
2-(2,6-diethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 62328197
2-[3-(2-methoxyethoxy)anilino]-N-(3-methylbutan-2-yl)acetamide
CID 87029683
3-ethyl-N-(3-methylbutan-2-yl)aniline
CID 43196057
N-(cyclopropylmethyl)-2-(3-ethylanilino)acetamide
CID 28584355
2-(3-ethylanilino)-N-(2-fluorophenyl)acetamide
CID 28584361
2-(3,4-difluoroanilino)-N-(3-ethylphenyl)acetamide
CID 112799800
2-(4-ethylphenyl)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 99626723
1-(3-ethylanilino)ethanol
CID 174601913

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide (CID 60688155) is 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide is CCc1cccc(NCC(=O)NC(C)C(C)C)c1.
What is the InChIKey of 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is MUFCUVOUSUBVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-5-13-7-6-8-14(9-13)16-10-15(18)17-12(4)11(2)3/h6-9,11-12,16H,5,10H2,1-4H3,(H,17,18).
What are the key properties of 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide?
2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 248.37 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 60688155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).