7-ethyl-1-piperidin-4-ylindole-2,3-dione

C15H18N2O2 — CID 84637175

IUPAC7-ethyl-1-piperidin-4-ylindole-2,3-dione
SMILESCCc1cccc2c1N(C1CCNCC1)C(=O)C2=O
InChIInChI=1S/C15H18N2O2/c1-2-10-4-3-5-12-13(10)17(15(19)14(12)18)11-6-8-16-9-7-11/h3-5,11,16H,2,6-9H2,1H3
InChIKeyMQSFLOZKDDYJHY-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.53
Rot. Bonds2

About 7-ethyl-1-piperidin-4-ylindole-2,3-dione

7-ethyl-1-piperidin-4-ylindole-2,3-dione (PubChem CID 84637175) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 7-ethyl-1-piperidin-4-ylindole-2,3-dione.

Molecular Properties

Compound Name7-ethyl-1-piperidin-4-ylindole-2,3-dione
PubChem CID84637175
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name7-ethyl-1-piperidin-4-ylindole-2,3-dione
SMILESCCc1cccc2c1N(C1CCNCC1)C(=O)C2=O
InChIInChI=1S/C15H18N2O2/c1-2-10-4-3-5-12-13(10)17(15(19)14(12)18)11-6-8-16-9-7-11/h3-5,11,16H,2,6-9H2,1H3
InChIKeyMQSFLOZKDDYJHY-UHFFFAOYSA-N
XLogP1.53
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 7-ethyl-1-piperidin-4-ylindole-2,3-dione?
The IUPAC name of 7-ethyl-1-piperidin-4-ylindole-2,3-dione (CID 84637175) is 7-ethyl-1-piperidin-4-ylindole-2,3-dione.
What is the SMILES notation for 7-ethyl-1-piperidin-4-ylindole-2,3-dione?
The canonical SMILES for 7-ethyl-1-piperidin-4-ylindole-2,3-dione is CCc1cccc2c1N(C1CCNCC1)C(=O)C2=O.
What is the InChIKey of 7-ethyl-1-piperidin-4-ylindole-2,3-dione?
The InChIKey is MQSFLOZKDDYJHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-10-4-3-5-12-13(10)17(15(19)14(12)18)11-6-8-16-9-7-11/h3-5,11,16H,2,6-9H2,1H3.
What are the key properties of 7-ethyl-1-piperidin-4-ylindole-2,3-dione?
7-ethyl-1-piperidin-4-ylindole-2,3-dione has a molecular weight of 258.32 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-1-piperidin-4-ylindole-2,3-dione is sourced from PubChem (CID 84637175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).