7-ethyl-5-methyl-1,3-dihydroindol-2-one

C11H13NO — CID 142337583

IUPAC7-ethyl-5-methyl-1,3-dihydroindol-2-one
SMILESCCc1cc(C)cc2c1NC(=O)C2
InChIInChI=1S/C11H13NO/c1-3-8-4-7(2)5-9-6-10(13)12-11(8)9/h4-5H,3,6H2,1-2H3,(H,12,13)
InChIKeyIIUUSAFXDPNKMM-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.05
Rot. Bonds1

About 7-ethyl-5-methyl-1,3-dihydroindol-2-one

7-ethyl-5-methyl-1,3-dihydroindol-2-one (PubChem CID 142337583) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 7-ethyl-5-methyl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-ethyl-5-methyl-1,3-dihydroindol-2-one
PubChem CID142337583
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name7-ethyl-5-methyl-1,3-dihydroindol-2-one
SMILESCCc1cc(C)cc2c1NC(=O)C2
InChIInChI=1S/C11H13NO/c1-3-8-4-7(2)5-9-6-10(13)12-11(8)9/h4-5H,3,6H2,1-2H3,(H,12,13)
InChIKeyIIUUSAFXDPNKMM-UHFFFAOYSA-N
XLogP2.05
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-5-methyl-1,3-dihydroindol-2-one?
The IUPAC name of 7-ethyl-5-methyl-1,3-dihydroindol-2-one (CID 142337583) is 7-ethyl-5-methyl-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-ethyl-5-methyl-1,3-dihydroindol-2-one?
The canonical SMILES for 7-ethyl-5-methyl-1,3-dihydroindol-2-one is CCc1cc(C)cc2c1NC(=O)C2.
What is the InChIKey of 7-ethyl-5-methyl-1,3-dihydroindol-2-one?
The InChIKey is IIUUSAFXDPNKMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-3-8-4-7(2)5-9-6-10(13)12-11(8)9/h4-5H,3,6H2,1-2H3,(H,12,13).
What are the key properties of 7-ethyl-5-methyl-1,3-dihydroindol-2-one?
7-ethyl-5-methyl-1,3-dihydroindol-2-one has a molecular weight of 175.23 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-5-methyl-1,3-dihydroindol-2-one is sourced from PubChem (CID 142337583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).