2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine

C10H20F3NO — CID 66275746

IUPAC2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine
SMILESCC(CNC(C)(C)C)OC(C)C(F)(F)F
InChIInChI=1S/C10H20F3NO/c1-7(6-14-9(3,4)5)15-8(2)10(11,12)13/h7-8,14H,6H2,1-5H3
InChIKeyITXZTQKPWGXPDK-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.73
Rot. Bonds4

About 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine

2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine (PubChem CID 66275746) has the molecular formula C10H20F3NO and a molecular weight of 227.27 g/mol. Its IUPAC name is 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine
PubChem CID66275746
Molecular FormulaC10H20F3NO
Molecular Weight227.27 g/mol
Exact Mass227.15
IUPAC Name2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine
SMILESCC(CNC(C)(C)C)OC(C)C(F)(F)F
InChIInChI=1S/C10H20F3NO/c1-7(6-14-9(3,4)5)15-8(2)10(11,12)13/h7-8,14H,6H2,1-5H3
InChIKeyITXZTQKPWGXPDK-UHFFFAOYSA-N
XLogP2.73
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-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 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine (CID 66275746) is 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine is CC(CNC(C)(C)C)OC(C)C(F)(F)F.
What is the InChIKey of 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine?
The InChIKey is ITXZTQKPWGXPDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3NO/c1-7(6-14-9(3,4)5)15-8(2)10(11,12)13/h7-8,14H,6H2,1-5H3.
What are the key properties of 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine?
2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine has a molecular weight of 227.27 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(1,1,1-trifluoropropan-2-yloxy)propyl]propan-2-amine is sourced from PubChem (CID 66275746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).