5-cycloheptyloxy-1H-indole

C15H19NO — CID 82923976

IUPAC5-cycloheptyloxy-1H-indole
SMILESc1cc2cc(OC3CCCCCC3)ccc2[nH]1
InChIInChI=1S/C15H19NO/c1-2-4-6-13(5-3-1)17-14-7-8-15-12(11-14)9-10-16-15/h7-11,13,16H,1-6H2
InChIKeyFIZKEDLIYIORDY-UHFFFAOYSA-N
MW229.32 g/mol
LogP4.27
Rot. Bonds2

About 5-cycloheptyloxy-1H-indole

5-cycloheptyloxy-1H-indole (PubChem CID 82923976) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 5-cycloheptyloxy-1H-indole.

Molecular Properties

Compound Name5-cycloheptyloxy-1H-indole
PubChem CID82923976
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name5-cycloheptyloxy-1H-indole
SMILESc1cc2cc(OC3CCCCCC3)ccc2[nH]1
InChIInChI=1S/C15H19NO/c1-2-4-6-13(5-3-1)17-14-7-8-15-12(11-14)9-10-16-15/h7-11,13,16H,1-6H2
InChIKeyFIZKEDLIYIORDY-UHFFFAOYSA-N
XLogP4.27
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-cycloheptyloxy-1H-indole?
The IUPAC name of 5-cycloheptyloxy-1H-indole (CID 82923976) is 5-cycloheptyloxy-1H-indole.
What is the SMILES notation for 5-cycloheptyloxy-1H-indole?
The canonical SMILES for 5-cycloheptyloxy-1H-indole is c1cc2cc(OC3CCCCCC3)ccc2[nH]1.
What is the InChIKey of 5-cycloheptyloxy-1H-indole?
The InChIKey is FIZKEDLIYIORDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-2-4-6-13(5-3-1)17-14-7-8-15-12(11-14)9-10-16-15/h7-11,13,16H,1-6H2.
What are the key properties of 5-cycloheptyloxy-1H-indole?
5-cycloheptyloxy-1H-indole has a molecular weight of 229.32 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cycloheptyloxy-1H-indole is sourced from PubChem (CID 82923976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).