2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide

C18H20N2O — CID 5203469

IUPAC2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CN1CCc2ccccc21)c1ccccc1
InChIInChI=1S/C18H20N2O/c1-14(15-7-3-2-4-8-15)19-18(21)13-20-12-11-16-9-5-6-10-17(16)20/h2-10,14H,11-13H2,1H3,(H,19,21)
InChIKeyCWSDHOFYTBAOON-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.93
Rot. Bonds4

About 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide

2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide (PubChem CID 5203469) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide
PubChem CID5203469
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CN1CCc2ccccc21)c1ccccc1
InChIInChI=1S/C18H20N2O/c1-14(15-7-3-2-4-8-15)19-18(21)13-20-12-11-16-9-5-6-10-17(16)20/h2-10,14H,11-13H2,1H3,(H,19,21)
InChIKeyCWSDHOFYTBAOON-UHFFFAOYSA-N
XLogP2.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide (CID 5203469) is 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide is CC(NC(=O)CN1CCc2ccccc21)c1ccccc1.
What is the InChIKey of 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide?
The InChIKey is CWSDHOFYTBAOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-14(15-7-3-2-4-8-15)19-18(21)13-20-12-11-16-9-5-6-10-17(16)20/h2-10,14H,11-13H2,1H3,(H,19,21).
What are the key properties of 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide?
2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroindol-1-yl)-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 5203469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).