2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol

C11H9F6NO — CID 13429008

IUPAC2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
SMILESOC(c1cccc2c1NCC2)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H9F6NO/c12-10(13,14)9(19,11(15,16)17)7-3-1-2-6-4-5-18-8(6)7/h1-3,18-19H,4-5H2
InChIKeyGDNRJZULOOHLTQ-UHFFFAOYSA-N
MW285.19 g/mol
LogP2.97
Rot. Bonds1

About 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol

2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol (PubChem CID 13429008) has the molecular formula C11H9F6NO and a molecular weight of 285.19 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
PubChem CID13429008
Molecular FormulaC11H9F6NO
Molecular Weight285.19 g/mol
Exact Mass285.06
IUPAC Name2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
SMILESOC(c1cccc2c1NCC2)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C11H9F6NO/c12-10(13,14)9(19,11(15,16)17)7-3-1-2-6-4-5-18-8(6)7/h1-3,18-19H,4-5H2
InChIKeyGDNRJZULOOHLTQ-UHFFFAOYSA-N
XLogP2.97
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.19
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
The IUPAC name of 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol (CID 13429008) is 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol is OC(c1cccc2c1NCC2)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
The InChIKey is GDNRJZULOOHLTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F6NO/c12-10(13,14)9(19,11(15,16)17)7-3-1-2-6-4-5-18-8(6)7/h1-3,18-19H,4-5H2.
What are the key properties of 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol?
2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol has a molecular weight of 285.19 g/mol, XLogP of 2.97, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-7-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol is sourced from PubChem (CID 13429008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).