2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine

C6H8F7N — CID 12655947

IUPAC2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine
SMILESCN(C)CC(F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H8F7N/c1-14(2)3-4(7,5(8,9)10)6(11,12)13/h3H2,1-2H3
InChIKeyIHOWKYYSHRRKKK-UHFFFAOYSA-N
MW227.12 g/mol
LogP2.38
Rot. Bonds2

About 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine

2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine (PubChem CID 12655947) has the molecular formula C6H8F7N and a molecular weight of 227.12 g/mol. Its IUPAC name is 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine.

Molecular Properties

Compound Name2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine
PubChem CID12655947
Molecular FormulaC6H8F7N
Molecular Weight227.12 g/mol
Exact Mass227.05
IUPAC Name2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine
SMILESCN(C)CC(F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H8F7N/c1-14(2)3-4(7,5(8,9)10)6(11,12)13/h3H2,1-2H3
InChIKeyIHOWKYYSHRRKKK-UHFFFAOYSA-N
XLogP2.38
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.12
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine?
The IUPAC name of 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine (CID 12655947) is 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine.
What is the SMILES notation for 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine?
The canonical SMILES for 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine is CN(C)CC(F)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine?
The InChIKey is IHOWKYYSHRRKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F7N/c1-14(2)3-4(7,5(8,9)10)6(11,12)13/h3H2,1-2H3.
What are the key properties of 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine?
2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine has a molecular weight of 227.12 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,3-tetrafluoro-N,N-dimethyl-2-(trifluoromethyl)propan-1-amine is sourced from PubChem (CID 12655947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).