3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one

C14H17NO — CID 106986757

IUPAC3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one
SMILESCC1CCCC1C1C(=O)Nc2ccccc21
InChIInChI=1S/C14H17NO/c1-9-5-4-7-10(9)13-11-6-2-3-8-12(11)15-14(13)16/h2-3,6,8-10,13H,4-5,7H2,1H3,(H,15,16)
InChIKeyJDOOINXSXUEWTK-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.16
Rot. Bonds1

About 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one

3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one (PubChem CID 106986757) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one
PubChem CID106986757
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one
SMILESCC1CCCC1C1C(=O)Nc2ccccc21
InChIInChI=1S/C14H17NO/c1-9-5-4-7-10(9)13-11-6-2-3-8-12(11)15-14(13)16/h2-3,6,8-10,13H,4-5,7H2,1H3,(H,15,16)
InChIKeyJDOOINXSXUEWTK-UHFFFAOYSA-N
XLogP3.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one?
The IUPAC name of 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one (CID 106986757) is 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one is CC1CCCC1C1C(=O)Nc2ccccc21.
What is the InChIKey of 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one?
The InChIKey is JDOOINXSXUEWTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-9-5-4-7-10(9)13-11-6-2-3-8-12(11)15-14(13)16/h2-3,6,8-10,13H,4-5,7H2,1H3,(H,15,16).
What are the key properties of 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one?
3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one has a molecular weight of 215.30 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylcyclopentyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 106986757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).