2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide

C16H24N2O2 — CID 113166154

IUPAC2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(C)cc(C)c1)C(C)(C)C
InChIInChI=1S/C16H24N2O2/c1-11-7-12(2)9-14(8-11)17-15(20)10-18(13(3)19)16(4,5)6/h7-9H,10H2,1-6H3,(H,17,20)
InChIKeyLJFDJPUWDLTLRU-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.89
Rot. Bonds3

About 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide

2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide (PubChem CID 113166154) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide
PubChem CID113166154
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1cc(C)cc(C)c1)C(C)(C)C
InChIInChI=1S/C16H24N2O2/c1-11-7-12(2)9-14(8-11)17-15(20)10-18(13(3)19)16(4,5)6/h7-9H,10H2,1-6H3,(H,17,20)
InChIKeyLJFDJPUWDLTLRU-UHFFFAOYSA-N
XLogP2.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl(tert-butyl)amino]-N-(4-methylphenyl)acetamide
CID 113166147
N-(3-acetamidophenyl)-2-[acetyl(tert-butyl)amino]acetamide
CID 113166199
2-[acetyl(tert-butyl)amino]-N-(1,3-benzodioxol-5-yl)acetamide
CID 113166222
2-[acetyl(tert-butyl)amino]-N-(2-methylphenyl)acetamide
CID 113166145
3-[acetyl(tert-butyl)amino]-N-(3-methylphenyl)propanamide
CID 113122510
N-(3,5-dimethylphenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide
CID 86976719
2-[acetyl(tert-butyl)amino]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
CID 113166205
2-[acetyl-(1,1-dioxothiolan-3-yl)amino]-N-(3,5-dimethylphenyl)acetamide
CID 113165037
2-(N-acetyl-4-ethylanilino)-N-(3,5-dimethylphenyl)acetamide
CID 113169304
3-[acetyl(tert-butyl)amino]-N-(2,4,6-trimethylphenyl)propanamide
CID 113122527
2-[acetyl(tert-butyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113166215
2-(N-acetyl-4-cyanoanilino)-N-(3,5-dimethylphenyl)acetamide
CID 113181116

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide?
The IUPAC name of 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide (CID 113166154) is 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide?
The canonical SMILES for 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide is CC(=O)N(CC(=O)Nc1cc(C)cc(C)c1)C(C)(C)C.
What is the InChIKey of 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide?
The InChIKey is LJFDJPUWDLTLRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11-7-12(2)9-14(8-11)17-15(20)10-18(13(3)19)16(4,5)6/h7-9H,10H2,1-6H3,(H,17,20).
What are the key properties of 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide?
2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(tert-butyl)amino]-N-(3,5-dimethylphenyl)acetamide is sourced from PubChem (CID 113166154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).