N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide

C19H20N2O3 — CID 91821459

IUPACN-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide
SMILESCC(C)n1ccc2c(OCC(=O)Nc3ccc(O)cc3)cccc21
InChIInChI=1S/C19H20N2O3/c1-13(2)21-11-10-16-17(21)4-3-5-18(16)24-12-19(23)20-14-6-8-15(22)9-7-14/h3-11,13,22H,12H2,1-2H3,(H,20,23)
InChIKeyZNLIPBZVGSDOML-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.95
Rot. Bonds5

About N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide

N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide (PubChem CID 91821459) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide
PubChem CID91821459
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC NameN-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide
SMILESCC(C)n1ccc2c(OCC(=O)Nc3ccc(O)cc3)cccc21
InChIInChI=1S/C19H20N2O3/c1-13(2)21-11-10-16-17(21)4-3-5-18(16)24-12-19(23)20-14-6-8-15(22)9-7-14/h3-11,13,22H,12H2,1-2H3,(H,20,23)
InChIKeyZNLIPBZVGSDOML-UHFFFAOYSA-N
XLogP3.95
TPSA63.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide?
The IUPAC name of N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide (CID 91821459) is N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide?
The canonical SMILES for N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide is CC(C)n1ccc2c(OCC(=O)Nc3ccc(O)cc3)cccc21.
What is the InChIKey of N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide?
The InChIKey is ZNLIPBZVGSDOML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-13(2)21-11-10-16-17(21)4-3-5-18(16)24-12-19(23)20-14-6-8-15(22)9-7-14/h3-11,13,22H,12H2,1-2H3,(H,20,23).
What are the key properties of N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide?
N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide has a molecular weight of 324.38 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-2-(1-propan-2-ylindol-4-yl)oxyacetamide is sourced from PubChem (CID 91821459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).