1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine

C10H18F3NO — CID 66276529

IUPAC1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
SMILESCCNC(COC(C)C(F)(F)F)C1CC1
InChIInChI=1S/C10H18F3NO/c1-3-14-9(8-4-5-8)6-15-7(2)10(11,12)13/h7-9,14H,3-6H2,1-2H3
InChIKeyASEBLXILXASPCL-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.34
Rot. Bonds6

About 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine

1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine (PubChem CID 66276529) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
PubChem CID66276529
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine
SMILESCCNC(COC(C)C(F)(F)F)C1CC1
InChIInChI=1S/C10H18F3NO/c1-3-14-9(8-4-5-8)6-15-7(2)10(11,12)13/h7-9,14H,3-6H2,1-2H3
InChIKeyASEBLXILXASPCL-UHFFFAOYSA-N
XLogP2.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
The IUPAC name of 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine (CID 66276529) is 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine is CCNC(COC(C)C(F)(F)F)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
The InChIKey is ASEBLXILXASPCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c1-3-14-9(8-4-5-8)6-15-7(2)10(11,12)13/h7-9,14H,3-6H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine?
1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine has a molecular weight of 225.25 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-2-(1,1,1-trifluoropropan-2-yloxy)ethanamine is sourced from PubChem (CID 66276529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).