2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide

C19H18N2O2 — CID 9429785

IUPAC2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide
SMILESCCCNC(=O)C(=O)c1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C19H18N2O2/c1-2-12-20-19(23)18(22)16-14-10-6-7-11-15(14)21-17(16)13-8-4-3-5-9-13/h3-11,21H,2,12H2,1H3,(H,20,23)
InChIKeyOICSQNDQHJZXDZ-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.54
Rot. Bonds5

About 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide

2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide (PubChem CID 9429785) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide.

Molecular Properties

Compound Name2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide
PubChem CID9429785
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide
SMILESCCCNC(=O)C(=O)c1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C19H18N2O2/c1-2-12-20-19(23)18(22)16-14-10-6-7-11-15(14)21-17(16)13-8-4-3-5-9-13/h3-11,21H,2,12H2,1H3,(H,20,23)
InChIKeyOICSQNDQHJZXDZ-UHFFFAOYSA-N
XLogP3.54
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide?
The IUPAC name of 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide (CID 9429785) is 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide.
What is the SMILES notation for 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide?
The canonical SMILES for 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide is CCCNC(=O)C(=O)c1c(-c2ccccc2)[nH]c2ccccc12.
What is the InChIKey of 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide?
The InChIKey is OICSQNDQHJZXDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-2-12-20-19(23)18(22)16-14-10-6-7-11-15(14)21-17(16)13-8-4-3-5-9-13/h3-11,21H,2,12H2,1H3,(H,20,23).
What are the key properties of 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide?
2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide has a molecular weight of 306.37 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-2-(2-phenyl-1H-indol-3-yl)-N-propylacetamide is sourced from PubChem (CID 9429785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).