2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide

C12H15N3O2 — CID 114993679

IUPAC2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide
SMILESCCc1ccc2c(c1)C(NCC(N)=O)C(=O)N2
InChIInChI=1S/C12H15N3O2/c1-2-7-3-4-9-8(5-7)11(12(17)15-9)14-6-10(13)16/h3-5,11,14H,2,6H2,1H3,(H2,13,16)(H,15,17)
InChIKeyPQTXMWCREKLSDF-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.32
Rot. Bonds4

About 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide

2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide (PubChem CID 114993679) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide.

Molecular Properties

Compound Name2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide
PubChem CID114993679
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide
SMILESCCc1ccc2c(c1)C(NCC(N)=O)C(=O)N2
InChIInChI=1S/C12H15N3O2/c1-2-7-3-4-9-8(5-7)11(12(17)15-9)14-6-10(13)16/h3-5,11,14H,2,6H2,1H3,(H2,13,16)(H,15,17)
InChIKeyPQTXMWCREKLSDF-UHFFFAOYSA-N
XLogP0.32
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide?
The IUPAC name of 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide (CID 114993679) is 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide.
What is the SMILES notation for 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide?
The canonical SMILES for 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide is CCc1ccc2c(c1)C(NCC(N)=O)C(=O)N2.
What is the InChIKey of 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide?
The InChIKey is PQTXMWCREKLSDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-2-7-3-4-9-8(5-7)11(12(17)15-9)14-6-10(13)16/h3-5,11,14H,2,6H2,1H3,(H2,13,16)(H,15,17).
What are the key properties of 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide?
2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide has a molecular weight of 233.27 g/mol, XLogP of 0.32, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethyl-2-oxo-1,3-dihydroindol-3-yl)amino]acetamide is sourced from PubChem (CID 114993679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).