2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide

C16H24N2O2 — CID 113168434

IUPAC2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide
SMILESCC(=O)N(CC(=O)NCC(C)C)c1cc(C)cc(C)c1
InChIInChI=1S/C16H24N2O2/c1-11(2)9-17-16(20)10-18(14(5)19)15-7-12(3)6-13(4)8-15/h6-8,11H,9-10H2,1-5H3,(H,17,20)
InChIKeyIZDXUOXWJHNZDT-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.43
Rot. Bonds5

About 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide

2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide (PubChem CID 113168434) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide
PubChem CID113168434
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide
SMILESCC(=O)N(CC(=O)NCC(C)C)c1cc(C)cc(C)c1
InChIInChI=1S/C16H24N2O2/c1-11(2)9-17-16(20)10-18(14(5)19)15-7-12(3)6-13(4)8-15/h6-8,11H,9-10H2,1-5H3,(H,17,20)
InChIKeyIZDXUOXWJHNZDT-UHFFFAOYSA-N
XLogP2.43
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-4-tert-butylanilino)-N-(2-methylpropyl)acetamide
CID 113170550
2-(N-acetyl-3-chloroanilino)-N-(2-methylpropyl)acetamide
CID 113171290
2-(N-acetyl-3,5-dimethylanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 113168537
2-(N-acetyl-3,5-dimethylanilino)-N-(pyridin-4-ylmethyl)acetamide
CID 113168470
2-(N-acetyl-2-methoxyanilino)-N-(2-methylpropyl)acetamide
CID 113173108
3-(N-acetyl-3,5-dichloroanilino)-N-(2-methylpropyl)propanamide
CID 113134052
2-(N-acetyl-3,5-dimethylanilino)-N-(4-chlorophenyl)acetamide
CID 113168546
2-(N-acetyl-3,5-dimethylanilino)-N-(3,4-dimethylphenyl)acetamide
CID 113168527
2-(N-acetyl-3,5-dimethylanilino)-N-(3-methylphenyl)acetamide
CID 113168520
2-(N-acetyl-3,5-dimethylanilino)-N-(4-acetylphenyl)acetamide
CID 113168572
2-(N-acetyl-2-chloroanilino)-N-(2-methylpropyl)acetamide
CID 113171103
2-(N-acetyl-3,5-dimethylanilino)-N-(1,3-benzodioxol-5-ylmethyl)acetamide
CID 113168466

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide (CID 113168434) is 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide is CC(=O)N(CC(=O)NCC(C)C)c1cc(C)cc(C)c1.
What is the InChIKey of 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide?
The InChIKey is IZDXUOXWJHNZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11(2)9-17-16(20)10-18(14(5)19)15-7-12(3)6-13(4)8-15/h6-8,11H,9-10H2,1-5H3,(H,17,20).
What are the key properties of 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide?
2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3,5-dimethylanilino)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 113168434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).