6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one

C15H19ClN2O — CID 62633530

IUPAC6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one
SMILESCC(Nc1cc2c(cc1Cl)NC(=O)C2)C1CCCC1
InChIInChI=1S/C15H19ClN2O/c1-9(10-4-2-3-5-10)17-14-6-11-7-15(19)18-13(11)8-12(14)16/h6,8-10,17H,2-5,7H2,1H3,(H,18,19)
InChIKeyKYUYIFFTVBBMQA-UHFFFAOYSA-N
MW278.78 g/mol
LogP3.83
Rot. Bonds3

About 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one

6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one (PubChem CID 62633530) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one
PubChem CID62633530
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC Name6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one
SMILESCC(Nc1cc2c(cc1Cl)NC(=O)C2)C1CCCC1
InChIInChI=1S/C15H19ClN2O/c1-9(10-4-2-3-5-10)17-14-6-11-7-15(19)18-13(11)8-12(14)16/h6,8-10,17H,2-5,7H2,1H3,(H,18,19)
InChIKeyKYUYIFFTVBBMQA-UHFFFAOYSA-N
XLogP3.83
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one (CID 62633530) is 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one is CC(Nc1cc2c(cc1Cl)NC(=O)C2)C1CCCC1.
What is the InChIKey of 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one?
The InChIKey is KYUYIFFTVBBMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O/c1-9(10-4-2-3-5-10)17-14-6-11-7-15(19)18-13(11)8-12(14)16/h6,8-10,17H,2-5,7H2,1H3,(H,18,19).
What are the key properties of 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one?
6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one has a molecular weight of 278.78 g/mol, XLogP of 3.83, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(1-cyclopentylethylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 62633530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).