azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride

C5H11ClF3N — CID 175348796

IUPACazane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride
SMILESCl.FC(F)[C@@H](F)C1CC1.N
InChIInChI=1S/C5H7F3.ClH.H3N/c6-4(5(7)8)3-1-2-3;;/h3-5H,1-2H2;1H;1H3/t4-;;/m0../s1
InChIKeyAMLOWVYTXPTCBM-FHNDMYTFSA-N
MW177.60 g/mol
LogP2.58
Rot. Bonds2

About azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride

azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride (PubChem CID 175348796) has the molecular formula C5H11ClF3N and a molecular weight of 177.60 g/mol. Its IUPAC name is azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride.

Molecular Properties

Compound Nameazane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride
PubChem CID175348796
Molecular FormulaC5H11ClF3N
Molecular Weight177.60 g/mol
Exact Mass177.05
IUPAC Nameazane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride
SMILESCl.FC(F)[C@@H](F)C1CC1.N
InChIInChI=1S/C5H7F3.ClH.H3N/c6-4(5(7)8)3-1-2-3;;/h3-5H,1-2H2;1H;1H3/t4-;;/m0../s1
InChIKeyAMLOWVYTXPTCBM-FHNDMYTFSA-N
XLogP2.58
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.60
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopropyl-1-fluoropropan-2-amine
CID 105427110
1-fluoroethylcyclopropane
CID 22262429
1,4-bis(1,2-difluoroethyl)cyclohexane
CID 91807449
1-fluoro-1-(thian-4-yl)propan-2-ol
CID 105437759
1-cyclohexyl-2,2-difluoroethanol;hydrochloride
CID 162337180
[2,2-difluoro-1-(4-methylcyclohexyl)ethyl]hydrazine
CID 105265151
(1S,2R)-2-amino-1-cyclopropyl-2-(2,3,4,5,6-pentafluorophenyl)ethanol;hydrochloride
CID 171160472
[(2S)-3-fluorobutan-2-yl]cyclopropane
CID 170226642
2-(1,2,2-trifluoroethyl)cyclohexane-1-carboxylic acid
CID 175486496
(1-cyclobutyl-2,2-difluoroethyl)hydrazine
CID 105265227
1-(1-cyclopropyl-2,2-difluoroethyl)cyclopropan-1-amine
CID 105431584
[(1S)-1-fluoropropyl]cyclopropane
CID 158184537

Frequently Asked Questions

What is the IUPAC name of azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride?
The IUPAC name of azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride (CID 175348796) is azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride.
What is the SMILES notation for azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride?
The canonical SMILES for azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride is Cl.FC(F)[C@@H](F)C1CC1.N.
What is the InChIKey of azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride?
The InChIKey is AMLOWVYTXPTCBM-FHNDMYTFSA-N. The full InChI is InChI=1S/C5H7F3.ClH.H3N/c6-4(5(7)8)3-1-2-3;;/h3-5H,1-2H2;1H;1H3/t4-;;/m0../s1.
What are the key properties of azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride?
azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride has a molecular weight of 177.60 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;[(1S)-1,2,2-trifluoroethyl]cyclopropane;hydrochloride is sourced from PubChem (CID 175348796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).