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

C7H14F3N — CID 89295063

IUPACN,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCC(C)CN(C)CC(F)(F)F
InChIInChI=1S/C7H14F3N/c1-6(2)4-11(3)5-7(8,9)10/h6H,4-5H2,1-3H3
InChIKeyQUHOBTRXQBLYAE-UHFFFAOYSA-N
MW169.19 g/mol
LogP2.14
Rot. Bonds3

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

N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine (PubChem CID 89295063) has the molecular formula C7H14F3N and a molecular weight of 169.19 g/mol. Its IUPAC name is N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
PubChem CID89295063
Molecular FormulaC7H14F3N
Molecular Weight169.19 g/mol
Exact Mass169.11
IUPAC NameN,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCC(C)CN(C)CC(F)(F)F
InChIInChI=1S/C7H14F3N/c1-6(2)4-11(3)5-7(8,9)10/h6H,4-5H2,1-3H3
InChIKeyQUHOBTRXQBLYAE-UHFFFAOYSA-N
XLogP2.14
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.19
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
The IUPAC name of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine (CID 89295063) is N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine.
What is the SMILES notation for N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
The canonical SMILES for N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine is CC(C)CN(C)CC(F)(F)F.
What is the InChIKey of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
The InChIKey is QUHOBTRXQBLYAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F3N/c1-6(2)4-11(3)5-7(8,9)10/h6H,4-5H2,1-3H3.
What are the key properties of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine?
N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine has a molecular weight of 169.19 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine is sourced from PubChem (CID 89295063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).