N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide

C21H24N2O2 — CID 53057444

IUPACN-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
SMILESCCc1ccc(NC(=O)CN2C(=O)C(C)(C)c3cc(C)ccc32)cc1
InChIInChI=1S/C21H24N2O2/c1-5-15-7-9-16(10-8-15)22-19(24)13-23-18-11-6-14(2)12-17(18)21(3,4)20(23)25/h6-12H,5,13H2,1-4H3,(H,22,24)
InChIKeySUKRELMAPMSLBS-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.82
Rot. Bonds4

About N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide

N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide (PubChem CID 53057444) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
PubChem CID53057444
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC NameN-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide
SMILESCCc1ccc(NC(=O)CN2C(=O)C(C)(C)c3cc(C)ccc32)cc1
InChIInChI=1S/C21H24N2O2/c1-5-15-7-9-16(10-8-15)22-19(24)13-23-18-11-6-14(2)12-17(18)21(3,4)20(23)25/h6-12H,5,13H2,1-4H3,(H,22,24)
InChIKeySUKRELMAPMSLBS-UHFFFAOYSA-N
XLogP3.82
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The IUPAC name of N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide (CID 53057444) is N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide is CCc1ccc(NC(=O)CN2C(=O)C(C)(C)c3cc(C)ccc32)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
The InChIKey is SUKRELMAPMSLBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c1-5-15-7-9-16(10-8-15)22-19(24)13-23-18-11-6-14(2)12-17(18)21(3,4)20(23)25/h6-12H,5,13H2,1-4H3,(H,22,24).
What are the key properties of N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide?
N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide has a molecular weight of 336.44 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(3,3,5-trimethyl-2-oxoindol-1-yl)acetamide is sourced from PubChem (CID 53057444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).