1-methyl-6-pyridin-3-yloxyindole

C14H12N2O — CID 118649526

IUPAC1-methyl-6-pyridin-3-yloxyindole
SMILESCn1ccc2ccc(Oc3cccnc3)cc21
InChIInChI=1S/C14H12N2O/c1-16-8-6-11-4-5-12(9-14(11)16)17-13-3-2-7-15-10-13/h2-10H,1H3
InChIKeyXHBRFNBZKDCNFE-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.37
Rot. Bonds2

About 1-methyl-6-pyridin-3-yloxyindole

1-methyl-6-pyridin-3-yloxyindole (PubChem CID 118649526) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 1-methyl-6-pyridin-3-yloxyindole.

Molecular Properties

Compound Name1-methyl-6-pyridin-3-yloxyindole
PubChem CID118649526
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name1-methyl-6-pyridin-3-yloxyindole
SMILESCn1ccc2ccc(Oc3cccnc3)cc21
InChIInChI=1S/C14H12N2O/c1-16-8-6-11-4-5-12(9-14(11)16)17-13-3-2-7-15-10-13/h2-10H,1H3
InChIKeyXHBRFNBZKDCNFE-UHFFFAOYSA-N
XLogP3.37
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-pyridin-3-yloxyindole?
The IUPAC name of 1-methyl-6-pyridin-3-yloxyindole (CID 118649526) is 1-methyl-6-pyridin-3-yloxyindole.
What is the SMILES notation for 1-methyl-6-pyridin-3-yloxyindole?
The canonical SMILES for 1-methyl-6-pyridin-3-yloxyindole is Cn1ccc2ccc(Oc3cccnc3)cc21.
What is the InChIKey of 1-methyl-6-pyridin-3-yloxyindole?
The InChIKey is XHBRFNBZKDCNFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-16-8-6-11-4-5-12(9-14(11)16)17-13-3-2-7-15-10-13/h2-10H,1H3.
What are the key properties of 1-methyl-6-pyridin-3-yloxyindole?
1-methyl-6-pyridin-3-yloxyindole has a molecular weight of 224.26 g/mol, XLogP of 3.37, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-pyridin-3-yloxyindole is sourced from PubChem (CID 118649526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).