2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide

C18H20N2O2 — CID 141490272

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide
SMILESCOc1ccc(NC(=O)CC2CNc3ccccc32)c(C)c1
InChIInChI=1S/C18H20N2O2/c1-12-9-14(22-2)7-8-16(12)20-18(21)10-13-11-19-17-6-4-3-5-15(13)17/h3-9,13,19H,10-11H2,1-2H3,(H,20,21)
InChIKeyKQNOCCCMBCETBB-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.54
Rot. Bonds4

About 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide

2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide (PubChem CID 141490272) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide
PubChem CID141490272
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide
SMILESCOc1ccc(NC(=O)CC2CNc3ccccc32)c(C)c1
InChIInChI=1S/C18H20N2O2/c1-12-9-14(22-2)7-8-16(12)20-18(21)10-13-11-19-17-6-4-3-5-15(13)17/h3-9,13,19H,10-11H2,1-2H3,(H,20,21)
InChIKeyKQNOCCCMBCETBB-UHFFFAOYSA-N
XLogP3.54
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide (CID 141490272) is 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide is COc1ccc(NC(=O)CC2CNc3ccccc32)c(C)c1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
The InChIKey is KQNOCCCMBCETBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-12-9-14(22-2)7-8-16(12)20-18(21)10-13-11-19-17-6-4-3-5-15(13)17/h3-9,13,19H,10-11H2,1-2H3,(H,20,21).
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide has a molecular weight of 296.37 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide is sourced from PubChem (CID 141490272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).