1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol

C10H18F3NO — CID 63905533

IUPAC1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESCCCN(CC(O)C1CC1)CC(F)(F)F
InChIInChI=1S/C10H18F3NO/c1-2-5-14(7-10(11,12)13)6-9(15)8-3-4-8/h8-9,15H,2-7H2,1H3
InChIKeyDHBFGGXWCIYOPX-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.03
Rot. Bonds6

About 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol

1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol (PubChem CID 63905533) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol
PubChem CID63905533
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESCCCN(CC(O)C1CC1)CC(F)(F)F
InChIInChI=1S/C10H18F3NO/c1-2-5-14(7-10(11,12)13)6-9(15)8-3-4-8/h8-9,15H,2-7H2,1H3
InChIKeyDHBFGGXWCIYOPX-UHFFFAOYSA-N
XLogP2.03
TPSA23.47 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 ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol (CID 63905533) is 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol is CCCN(CC(O)C1CC1)CC(F)(F)F.
What is the InChIKey of 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol?
The InChIKey is DHBFGGXWCIYOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c1-2-5-14(7-10(11,12)13)6-9(15)8-3-4-8/h8-9,15H,2-7H2,1H3.
What are the key properties of 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol?
1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol has a molecular weight of 225.25 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[propyl(2,2,2-trifluoroethyl)amino]ethanol is sourced from PubChem (CID 63905533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).