3-cyclohexyl-5-(difluoromethoxy)-1H-indole

C15H17F2NO — CID 106985011

IUPAC3-cyclohexyl-5-(difluoromethoxy)-1H-indole
SMILESFC(F)Oc1ccc2[nH]cc(C3CCCCC3)c2c1
InChIInChI=1S/C15H17F2NO/c16-15(17)19-11-6-7-14-12(8-11)13(9-18-14)10-4-2-1-3-5-10/h6-10,15,18H,1-5H2
InChIKeyBGIFXDCOWANAIY-UHFFFAOYSA-N
MW265.30 g/mol
LogP4.82
Rot. Bonds3

About 3-cyclohexyl-5-(difluoromethoxy)-1H-indole

3-cyclohexyl-5-(difluoromethoxy)-1H-indole (PubChem CID 106985011) has the molecular formula C15H17F2NO and a molecular weight of 265.30 g/mol. Its IUPAC name is 3-cyclohexyl-5-(difluoromethoxy)-1H-indole.

Molecular Properties

Compound Name3-cyclohexyl-5-(difluoromethoxy)-1H-indole
PubChem CID106985011
Molecular FormulaC15H17F2NO
Molecular Weight265.30 g/mol
Exact Mass265.13
IUPAC Name3-cyclohexyl-5-(difluoromethoxy)-1H-indole
SMILESFC(F)Oc1ccc2[nH]cc(C3CCCCC3)c2c1
InChIInChI=1S/C15H17F2NO/c16-15(17)19-11-6-7-14-12(8-11)13(9-18-14)10-4-2-1-3-5-10/h6-10,15,18H,1-5H2
InChIKeyBGIFXDCOWANAIY-UHFFFAOYSA-N
XLogP4.82
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.30
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-5-(difluoromethoxy)-1H-indole?
The IUPAC name of 3-cyclohexyl-5-(difluoromethoxy)-1H-indole (CID 106985011) is 3-cyclohexyl-5-(difluoromethoxy)-1H-indole.
What is the SMILES notation for 3-cyclohexyl-5-(difluoromethoxy)-1H-indole?
The canonical SMILES for 3-cyclohexyl-5-(difluoromethoxy)-1H-indole is FC(F)Oc1ccc2[nH]cc(C3CCCCC3)c2c1.
What is the InChIKey of 3-cyclohexyl-5-(difluoromethoxy)-1H-indole?
The InChIKey is BGIFXDCOWANAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17F2NO/c16-15(17)19-11-6-7-14-12(8-11)13(9-18-14)10-4-2-1-3-5-10/h6-10,15,18H,1-5H2.
What are the key properties of 3-cyclohexyl-5-(difluoromethoxy)-1H-indole?
3-cyclohexyl-5-(difluoromethoxy)-1H-indole has a molecular weight of 265.30 g/mol, XLogP of 4.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-5-(difluoromethoxy)-1H-indole is sourced from PubChem (CID 106985011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).