3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one

C15H14N2O2 — CID 63369724

IUPAC3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one
SMILESCc1ccccc1Oc1ccc2c(c1)NC(=O)C2N
InChIInChI=1S/C15H14N2O2/c1-9-4-2-3-5-13(9)19-10-6-7-11-12(8-10)17-15(18)14(11)16/h2-8,14H,16H2,1H3,(H,17,18)
InChIKeyRPHHPAKLHQGUKU-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.74
Rot. Bonds2

About 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one

3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one (PubChem CID 63369724) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one
PubChem CID63369724
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one
SMILESCc1ccccc1Oc1ccc2c(c1)NC(=O)C2N
InChIInChI=1S/C15H14N2O2/c1-9-4-2-3-5-13(9)19-10-6-7-11-12(8-10)17-15(18)14(11)16/h2-8,14H,16H2,1H3,(H,17,18)
InChIKeyRPHHPAKLHQGUKU-UHFFFAOYSA-N
XLogP2.74
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one?
The IUPAC name of 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one (CID 63369724) is 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one?
The canonical SMILES for 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one is Cc1ccccc1Oc1ccc2c(c1)NC(=O)C2N.
What is the InChIKey of 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one?
The InChIKey is RPHHPAKLHQGUKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-9-4-2-3-5-13(9)19-10-6-7-11-12(8-10)17-15(18)14(11)16/h2-8,14H,16H2,1H3,(H,17,18).
What are the key properties of 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one?
3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one has a molecular weight of 254.29 g/mol, XLogP of 2.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(2-methylphenoxy)-1,3-dihydroindol-2-one is sourced from PubChem (CID 63369724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).