trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride

C6H11ClF3NO — CID 178200244

IUPACtrans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride
SMILESCl.N[C@H]1CCC[C@]1(O)C(F)(F)F
InChIInChI=1S/C6H10F3NO.ClH/c7-6(8,9)5(11)3-1-2-4(5)10;/h4,11H,1-3,10H2;1H/t4-,5+;/m0./s1
InChIKeyQKXKUONXILCRQV-UYXJWNHNSA-N
MW205.61 g/mol
LogP1.21
Rot. Bonds

About trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride

trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride (PubChem CID 178200244) has the molecular formula C6H11ClF3NO and a molecular weight of 205.61 g/mol. Its IUPAC name is trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride.

Molecular Properties

Compound Nametrans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride
PubChem CID178200244
Molecular FormulaC6H11ClF3NO
Molecular Weight205.61 g/mol
Exact Mass205.05
IUPAC Nametrans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride
SMILESCl.N[C@H]1CCC[C@]1(O)C(F)(F)F
InChIInChI=1S/C6H10F3NO.ClH/c7-6(8,9)5(11)3-1-2-4(5)10;/h4,11H,1-3,10H2;1H/t4-,5+;/m0./s1
InChIKeyQKXKUONXILCRQV-UYXJWNHNSA-N
XLogP1.21
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.61
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride?
The IUPAC name of trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride (CID 178200244) is trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride.
What is the SMILES notation for trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride?
The canonical SMILES for trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride is Cl.N[C@H]1CCC[C@]1(O)C(F)(F)F.
What is the InChIKey of trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride?
The InChIKey is QKXKUONXILCRQV-UYXJWNHNSA-N. The full InChI is InChI=1S/C6H10F3NO.ClH/c7-6(8,9)5(11)3-1-2-4(5)10;/h4,11H,1-3,10H2;1H/t4-,5+;/m0./s1.
What are the key properties of trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride?
trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride has a molecular weight of 205.61 g/mol, XLogP of 1.21, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2S)-2-amino-1-(trifluoromethyl)cyclopentan-1-ol;hydrochloride is sourced from PubChem (CID 178200244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).