6-naphthalen-1-yl-1H-indole

C18H13N — CID 19779684

IUPAC6-naphthalen-1-yl-1H-indole
SMILESc1ccc2c(-c3ccc4cc[nH]c4c3)cccc2c1
InChIInChI=1S/C18H13N/c1-2-6-16-13(4-1)5-3-7-17(16)15-9-8-14-10-11-19-18(14)12-15/h1-12,19H
InChIKeySPBKHYWRBQVMAZ-UHFFFAOYSA-N
MW243.31 g/mol
LogP4.99
Rot. Bonds1

About 6-naphthalen-1-yl-1H-indole

6-naphthalen-1-yl-1H-indole (PubChem CID 19779684) has the molecular formula C18H13N and a molecular weight of 243.31 g/mol. Its IUPAC name is 6-naphthalen-1-yl-1H-indole.

Molecular Properties

Compound Name6-naphthalen-1-yl-1H-indole
PubChem CID19779684
Molecular FormulaC18H13N
Molecular Weight243.31 g/mol
Exact Mass243.10
IUPAC Name6-naphthalen-1-yl-1H-indole
SMILESc1ccc2c(-c3ccc4cc[nH]c4c3)cccc2c1
InChIInChI=1S/C18H13N/c1-2-6-16-13(4-1)5-3-7-17(16)15-9-8-14-10-11-19-18(14)12-15/h1-12,19H
InChIKeySPBKHYWRBQVMAZ-UHFFFAOYSA-N
XLogP4.99
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 6-naphthalen-1-yl-1H-indole?
The IUPAC name of 6-naphthalen-1-yl-1H-indole (CID 19779684) is 6-naphthalen-1-yl-1H-indole.
What is the SMILES notation for 6-naphthalen-1-yl-1H-indole?
The canonical SMILES for 6-naphthalen-1-yl-1H-indole is c1ccc2c(-c3ccc4cc[nH]c4c3)cccc2c1.
What is the InChIKey of 6-naphthalen-1-yl-1H-indole?
The InChIKey is SPBKHYWRBQVMAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N/c1-2-6-16-13(4-1)5-3-7-17(16)15-9-8-14-10-11-19-18(14)12-15/h1-12,19H.
What are the key properties of 6-naphthalen-1-yl-1H-indole?
6-naphthalen-1-yl-1H-indole has a molecular weight of 243.31 g/mol, XLogP of 4.99, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-naphthalen-1-yl-1H-indole is sourced from PubChem (CID 19779684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).