(1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol

C10H10F3NO — CID 139121260

IUPAC(1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol
SMILESCN1Cc2ccccc2[C@@]1(O)C(F)(F)F
InChIInChI=1S/C10H10F3NO/c1-14-6-7-4-2-3-5-8(7)9(14,15)10(11,12)13/h2-5,15H,6H2,1H3/t9-/m1/s1
InChIKeyHHAGFIBWYTWECV-SECBINFHSA-N
MW217.19 g/mol
LogP1.84
Rot. Bonds

About (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol

(1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol (PubChem CID 139121260) has the molecular formula C10H10F3NO and a molecular weight of 217.19 g/mol. Its IUPAC name is (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol.

Molecular Properties

Compound Name(1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol
PubChem CID139121260
Molecular FormulaC10H10F3NO
Molecular Weight217.19 g/mol
Exact Mass217.07
IUPAC Name(1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol
SMILESCN1Cc2ccccc2[C@@]1(O)C(F)(F)F
InChIInChI=1S/C10H10F3NO/c1-14-6-7-4-2-3-5-8(7)9(14,15)10(11,12)13/h2-5,15H,6H2,1H3/t9-/m1/s1
InChIKeyHHAGFIBWYTWECV-SECBINFHSA-N
XLogP1.84
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.19
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol?
The IUPAC name of (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol (CID 139121260) is (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol.
What is the SMILES notation for (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol?
The canonical SMILES for (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol is CN1Cc2ccccc2[C@@]1(O)C(F)(F)F.
What is the InChIKey of (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol?
The InChIKey is HHAGFIBWYTWECV-SECBINFHSA-N. The full InChI is InChI=1S/C10H10F3NO/c1-14-6-7-4-2-3-5-8(7)9(14,15)10(11,12)13/h2-5,15H,6H2,1H3/t9-/m1/s1.
What are the key properties of (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol?
(1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol has a molecular weight of 217.19 g/mol, XLogP of 1.84, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-methyl-1-(trifluoromethyl)-3H-isoindol-1-ol is sourced from PubChem (CID 139121260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).