2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol

C12H14FNO — CID 175731696

IUPAC2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol
SMILESCC(C)(F)C(O)c1cc2ccccc2[nH]1
InChIInChI=1S/C12H14FNO/c1-12(2,13)11(15)10-7-8-5-3-4-6-9(8)14-10/h3-7,11,14-15H,1-2H3
InChIKeyRXCAEDJFEJXNDA-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.95
Rot. Bonds2

About 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol

2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol (PubChem CID 175731696) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol
PubChem CID175731696
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol
SMILESCC(C)(F)C(O)c1cc2ccccc2[nH]1
InChIInChI=1S/C12H14FNO/c1-12(2,13)11(15)10-7-8-5-3-4-6-9(8)14-10/h3-7,11,14-15H,1-2H3
InChIKeyRXCAEDJFEJXNDA-UHFFFAOYSA-N
XLogP2.95
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol?
The IUPAC name of 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol (CID 175731696) is 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol?
The canonical SMILES for 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol is CC(C)(F)C(O)c1cc2ccccc2[nH]1.
What is the InChIKey of 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol?
The InChIKey is RXCAEDJFEJXNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-12(2,13)11(15)10-7-8-5-3-4-6-9(8)14-10/h3-7,11,14-15H,1-2H3.
What are the key properties of 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol?
2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol has a molecular weight of 207.25 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 175731696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).