N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride

C6H11ClF3N — CID 90259041

IUPACN-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride
SMILESCN(CC(F)(F)F)C1CC1.Cl
InChIInChI=1S/C6H10F3N.ClH/c1-10(5-2-3-5)4-6(7,8)9;/h5H,2-4H2,1H3;1H
InChIKeyJVHFIQSIBBUZLR-UHFFFAOYSA-N
MW189.61 g/mol
LogP2.06
Rot. Bonds2

About N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride

N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride (PubChem CID 90259041) has the molecular formula C6H11ClF3N and a molecular weight of 189.61 g/mol. Its IUPAC name is N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride
PubChem CID90259041
Molecular FormulaC6H11ClF3N
Molecular Weight189.61 g/mol
Exact Mass189.05
IUPAC NameN-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride
SMILESCN(CC(F)(F)F)C1CC1.Cl
InChIInChI=1S/C6H10F3N.ClH/c1-10(5-2-3-5)4-6(7,8)9;/h5H,2-4H2,1H3;1H
InChIKeyJVHFIQSIBBUZLR-UHFFFAOYSA-N
XLogP2.06
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.61
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride?
The IUPAC name of N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride (CID 90259041) is N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride.
What is the SMILES notation for N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride?
The canonical SMILES for N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride is CN(CC(F)(F)F)C1CC1.Cl.
What is the InChIKey of N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride?
The InChIKey is JVHFIQSIBBUZLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3N.ClH/c1-10(5-2-3-5)4-6(7,8)9;/h5H,2-4H2,1H3;1H.
What are the key properties of N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride?
N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride has a molecular weight of 189.61 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2,2,2-trifluoroethyl)cyclopropanamine;hydrochloride is sourced from PubChem (CID 90259041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).