N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine

C11H22F3NO — CID 176694566

IUPACN-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine
SMILESCCN(CC(C)OC(C)C(F)(F)F)C(C)C
InChIInChI=1S/C11H22F3NO/c1-6-15(8(2)3)7-9(4)16-10(5)11(12,13)14/h8-10H,6-7H2,1-5H3
InChIKeyUZXABICLMHZVNE-UHFFFAOYSA-N
MW241.30 g/mol
LogP3.07
Rot. Bonds6

About N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine

N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine (PubChem CID 176694566) has the molecular formula C11H22F3NO and a molecular weight of 241.30 g/mol. Its IUPAC name is N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine
PubChem CID176694566
Molecular FormulaC11H22F3NO
Molecular Weight241.30 g/mol
Exact Mass241.17
IUPAC NameN-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine
SMILESCCN(CC(C)OC(C)C(F)(F)F)C(C)C
InChIInChI=1S/C11H22F3NO/c1-6-15(8(2)3)7-9(4)16-10(5)11(12,13)14/h8-10H,6-7H2,1-5H3
InChIKeyUZXABICLMHZVNE-UHFFFAOYSA-N
XLogP3.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine?
The IUPAC name of N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine (CID 176694566) is N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine.
What is the SMILES notation for N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine?
The canonical SMILES for N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine is CCN(CC(C)OC(C)C(F)(F)F)C(C)C.
What is the InChIKey of N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine?
The InChIKey is UZXABICLMHZVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F3NO/c1-6-15(8(2)3)7-9(4)16-10(5)11(12,13)14/h8-10H,6-7H2,1-5H3.
What are the key properties of N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine?
N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine has a molecular weight of 241.30 g/mol, XLogP of 3.07, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propan-2-yl-2-(1,1,1-trifluoropropan-2-yloxy)propan-1-amine is sourced from PubChem (CID 176694566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).