N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine

C7H14F3N — CID 23273493

IUPACN-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCCCN(CC)CC(F)(F)F
InChIInChI=1S/C7H14F3N/c1-3-5-11(4-2)6-7(8,9)10/h3-6H2,1-2H3
InChIKeyZRJIRWZSNUMLPV-UHFFFAOYSA-N
MW169.19 g/mol
LogP2.28
Rot. Bonds4

About N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine

N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine (PubChem CID 23273493) has the molecular formula C7H14F3N and a molecular weight of 169.19 g/mol. Its IUPAC name is N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
PubChem CID23273493
Molecular FormulaC7H14F3N
Molecular Weight169.19 g/mol
Exact Mass169.11
IUPAC NameN-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCCCN(CC)CC(F)(F)F
InChIInChI=1S/C7H14F3N/c1-3-5-11(4-2)6-7(8,9)10/h3-6H2,1-2H3
InChIKeyZRJIRWZSNUMLPV-UHFFFAOYSA-N
XLogP2.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.19
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
The IUPAC name of N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine (CID 23273493) is N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine.
What is the SMILES notation for N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
The canonical SMILES for N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine is CCCN(CC)CC(F)(F)F.
What is the InChIKey of N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
The InChIKey is ZRJIRWZSNUMLPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3N/c1-3-5-11(4-2)6-7(8,9)10/h3-6H2,1-2H3.
What are the key properties of N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine has a molecular weight of 169.19 g/mol, XLogP of 2.28, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2,2,2-trifluoroethyl)propan-1-amine is sourced from PubChem (CID 23273493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).