3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one

C14H13N3O2 — CID 55184082

IUPAC3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one
SMILESCc1ccc(Oc2ccc3c(c2)NC(=O)C3N)cn1
InChIInChI=1S/C14H13N3O2/c1-8-2-3-10(7-16-8)19-9-4-5-11-12(6-9)17-14(18)13(11)15/h2-7,13H,15H2,1H3,(H,17,18)
InChIKeyQTNPBZMMFONAAE-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.13
Rot. Bonds2

About 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one

3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one (PubChem CID 55184082) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one
PubChem CID55184082
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC Name3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one
SMILESCc1ccc(Oc2ccc3c(c2)NC(=O)C3N)cn1
InChIInChI=1S/C14H13N3O2/c1-8-2-3-10(7-16-8)19-9-4-5-11-12(6-9)17-14(18)13(11)15/h2-7,13H,15H2,1H3,(H,17,18)
InChIKeyQTNPBZMMFONAAE-UHFFFAOYSA-N
XLogP2.13
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one?
The IUPAC name of 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one (CID 55184082) is 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one?
The canonical SMILES for 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one is Cc1ccc(Oc2ccc3c(c2)NC(=O)C3N)cn1.
What is the InChIKey of 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one?
The InChIKey is QTNPBZMMFONAAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c1-8-2-3-10(7-16-8)19-9-4-5-11-12(6-9)17-14(18)13(11)15/h2-7,13H,15H2,1H3,(H,17,18).
What are the key properties of 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one?
3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one has a molecular weight of 255.28 g/mol, XLogP of 2.13, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-[(6-methyl-3-pyridinyl)oxy]-1,3-dihydroindol-2-one is sourced from PubChem (CID 55184082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).