1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol

C11H14F3NO — CID 2966560

IUPAC1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol
SMILESCC(O)CNCc1ccccc1C(F)(F)F
InChIInChI=1S/C11H14F3NO/c1-8(16)6-15-7-9-4-2-3-5-10(9)11(12,13)14/h2-5,8,15-16H,6-7H2,1H3
InChIKeyCOLNLGOJGCMBDK-UHFFFAOYSA-N
MW233.23 g/mol
LogP2.18
Rot. Bonds4

About 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol

1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol (PubChem CID 2966560) has the molecular formula C11H14F3NO and a molecular weight of 233.23 g/mol. Its IUPAC name is 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol.

Molecular Properties

Compound Name1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol
PubChem CID2966560
Molecular FormulaC11H14F3NO
Molecular Weight233.23 g/mol
Exact Mass233.10
IUPAC Name1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol
SMILESCC(O)CNCc1ccccc1C(F)(F)F
InChIInChI=1S/C11H14F3NO/c1-8(16)6-15-7-9-4-2-3-5-10(9)11(12,13)14/h2-5,8,15-16H,6-7H2,1H3
InChIKeyCOLNLGOJGCMBDK-UHFFFAOYSA-N
XLogP2.18
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol?
The IUPAC name of 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol (CID 2966560) is 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol.
What is the SMILES notation for 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol?
The canonical SMILES for 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol is CC(O)CNCc1ccccc1C(F)(F)F.
What is the InChIKey of 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol?
The InChIKey is COLNLGOJGCMBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3NO/c1-8(16)6-15-7-9-4-2-3-5-10(9)11(12,13)14/h2-5,8,15-16H,6-7H2,1H3.
What are the key properties of 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol?
1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol has a molecular weight of 233.23 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(trifluoromethyl)phenyl]methylamino]propan-2-ol is sourced from PubChem (CID 2966560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).