2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide

C18H24N2O4 — CID 154810739

IUPAC2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESCc1ccc(OCC(=O)NC2CCC(=O)NC2=O)c(C(C)(C)C)c1
InChIInChI=1S/C18H24N2O4/c1-11-5-7-14(12(9-11)18(2,3)4)24-10-16(22)19-13-6-8-15(21)20-17(13)23/h5,7,9,13H,6,8,10H2,1-4H3,(H,19,22)(H,20,21,23)
InChIKeyCXAAFXYAMNLNRI-UHFFFAOYSA-N
MW332.40 g/mol
LogP1.59
Rot. Bonds4

About 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide

2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide (PubChem CID 154810739) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide
PubChem CID154810739
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC Name2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide
SMILESCc1ccc(OCC(=O)NC2CCC(=O)NC2=O)c(C(C)(C)C)c1
InChIInChI=1S/C18H24N2O4/c1-11-5-7-14(12(9-11)18(2,3)4)24-10-16(22)19-13-6-8-15(21)20-17(13)23/h5,7,9,13H,6,8,10H2,1-4H3,(H,19,22)(H,20,21,23)
InChIKeyCXAAFXYAMNLNRI-UHFFFAOYSA-N
XLogP1.59
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

2-(2,4-ditert-butylphenoxy)-N-[2-[[2-(2,4-ditert-butylphenoxy)acetyl]amino]cyclohexyl]acetamide
CID 17357144
N-(2,6-dioxopiperidin-3-yl)-3-methoxy-3-methylbutanamide
CID 103021311
2-(2-tert-butyl-4-methylphenoxy)-N-[1-(3,4-dimethylbenzoyl)piperidin-4-yl]acetamide
CID 108552716
N-[(1R)-1-[(1S,2S,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-(2-tert-butyl-4-methylphenoxy)acetamide
CID 50904841
3-[[2-(2-tert-butyl-4-methylphenoxy)acetyl]amino]propanoic acid
CID 9157836
2-(2-tert-butyl-4-methylphenoxy)-N-[1-(2-chlorobenzoyl)piperidin-4-yl]acetamide
CID 108552692
methyl 2-[[[2-(2-tert-butyl-4-methylphenoxy)acetyl]amino]methyl]cyclohexane-1-carboxylate
CID 108767585
2-(2-tert-butyl-4-methylphenoxy)-N-[1-(furan-2-carbonyl)piperidin-4-yl]acetamide
CID 108552688
N-[1-[2-(2-tert-butyl-4-methylphenoxy)acetyl]piperidin-4-yl]-3,3-dimethylbutanamide
CID 108564984
N-[(3S)-2,6-dioxopiperidin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 95988791
N-benzhydryl-2-(2-tert-butyl-4-methylphenoxy)acetamide
CID 19169265
N-[2-[[2-(2-tert-butyl-4-methylphenoxy)acetyl]amino]ethyl]-2-phenoxyacetamide
CID 108541189

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The IUPAC name of 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide (CID 154810739) is 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The canonical SMILES for 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide is Cc1ccc(OCC(=O)NC2CCC(=O)NC2=O)c(C(C)(C)C)c1.
What is the InChIKey of 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide?
The InChIKey is CXAAFXYAMNLNRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-11-5-7-14(12(9-11)18(2,3)4)24-10-16(22)19-13-6-8-15(21)20-17(13)23/h5,7,9,13H,6,8,10H2,1-4H3,(H,19,22)(H,20,21,23).
What are the key properties of 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide?
2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide has a molecular weight of 332.40 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-4-methylphenoxy)-N-(2,6-dioxopiperidin-3-yl)acetamide is sourced from PubChem (CID 154810739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).