(2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride

C7H13ClF3NO — CID 169093192

IUPAC(2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride
SMILESCl.N[C@@H](CO)CC1(C(F)(F)F)CC1
InChIInChI=1S/C7H12F3NO.ClH/c8-7(9,10)6(1-2-6)3-5(11)4-12;/h5,12H,1-4,11H2;1H/t5-;/m1./s1
InChIKeyYSOSHJFOJFXCRW-NUBCRITNSA-N
MW219.63 g/mol
LogP1.46
Rot. Bonds3

About (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride

(2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride (PubChem CID 169093192) has the molecular formula C7H13ClF3NO and a molecular weight of 219.63 g/mol. Its IUPAC name is (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride
PubChem CID169093192
Molecular FormulaC7H13ClF3NO
Molecular Weight219.63 g/mol
Exact Mass219.06
IUPAC Name(2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride
SMILESCl.N[C@@H](CO)CC1(C(F)(F)F)CC1
InChIInChI=1S/C7H12F3NO.ClH/c8-7(9,10)6(1-2-6)3-5(11)4-12;/h5,12H,1-4,11H2;1H/t5-;/m1./s1
InChIKeyYSOSHJFOJFXCRW-NUBCRITNSA-N
XLogP1.46
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.63
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride 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 (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride?
The IUPAC name of (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride (CID 169093192) is (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride.
What is the SMILES notation for (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride?
The canonical SMILES for (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride is Cl.N[C@@H](CO)CC1(C(F)(F)F)CC1.
What is the InChIKey of (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride?
The InChIKey is YSOSHJFOJFXCRW-NUBCRITNSA-N. The full InChI is InChI=1S/C7H12F3NO.ClH/c8-7(9,10)6(1-2-6)3-5(11)4-12;/h5,12H,1-4,11H2;1H/t5-;/m1./s1.
What are the key properties of (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride?
(2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride has a molecular weight of 219.63 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-[1-(trifluoromethyl)cyclopropyl]propan-1-ol;hydrochloride is sourced from PubChem (CID 169093192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).