2-naphthalen-1-yloxy-1H-indole

C18H13NO — CID 22381013

IUPAC2-naphthalen-1-yloxy-1H-indole
SMILESc1ccc2[nH]c(Oc3cccc4ccccc34)cc2c1
InChIInChI=1S/C18H13NO/c1-3-9-15-13(6-1)8-5-11-17(15)20-18-12-14-7-2-4-10-16(14)19-18/h1-12,19H
InChIKeyOHAVOWKOAKWFLR-UHFFFAOYSA-N
MW259.31 g/mol
LogP5.11
Rot. Bonds2

About 2-naphthalen-1-yloxy-1H-indole

2-naphthalen-1-yloxy-1H-indole (PubChem CID 22381013) has the molecular formula C18H13NO and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-naphthalen-1-yloxy-1H-indole.

Molecular Properties

Compound Name2-naphthalen-1-yloxy-1H-indole
PubChem CID22381013
Molecular FormulaC18H13NO
Molecular Weight259.31 g/mol
Exact Mass259.10
IUPAC Name2-naphthalen-1-yloxy-1H-indole
SMILESc1ccc2[nH]c(Oc3cccc4ccccc34)cc2c1
InChIInChI=1S/C18H13NO/c1-3-9-15-13(6-1)8-5-11-17(15)20-18-12-14-7-2-4-10-16(14)19-18/h1-12,19H
InChIKeyOHAVOWKOAKWFLR-UHFFFAOYSA-N
XLogP5.11
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.31
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yloxy-1H-indole?
The IUPAC name of 2-naphthalen-1-yloxy-1H-indole (CID 22381013) is 2-naphthalen-1-yloxy-1H-indole.
What is the SMILES notation for 2-naphthalen-1-yloxy-1H-indole?
The canonical SMILES for 2-naphthalen-1-yloxy-1H-indole is c1ccc2[nH]c(Oc3cccc4ccccc34)cc2c1.
What is the InChIKey of 2-naphthalen-1-yloxy-1H-indole?
The InChIKey is OHAVOWKOAKWFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c1-3-9-15-13(6-1)8-5-11-17(15)20-18-12-14-7-2-4-10-16(14)19-18/h1-12,19H.
What are the key properties of 2-naphthalen-1-yloxy-1H-indole?
2-naphthalen-1-yloxy-1H-indole has a molecular weight of 259.31 g/mol, XLogP of 5.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yloxy-1H-indole is sourced from PubChem (CID 22381013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).