2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol

C11H19F3N2O — CID 64825690

IUPAC2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol
SMILESNC(CO)(CN(CC(F)(F)F)C1CC1)C1CC1
InChIInChI=1S/C11H19F3N2O/c12-11(13,14)6-16(9-3-4-9)5-10(15,7-17)8-1-2-8/h8-9,17H,1-7,15H2
InChIKeyOPSKZAVTHNBWET-UHFFFAOYSA-N
MW252.28 g/mol
LogP1.11
Rot. Bonds6

About 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol

2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol (PubChem CID 64825690) has the molecular formula C11H19F3N2O and a molecular weight of 252.28 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol
PubChem CID64825690
Molecular FormulaC11H19F3N2O
Molecular Weight252.28 g/mol
Exact Mass252.14
IUPAC Name2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol
SMILESNC(CO)(CN(CC(F)(F)F)C1CC1)C1CC1
InChIInChI=1S/C11H19F3N2O/c12-11(13,14)6-16(9-3-4-9)5-10(15,7-17)8-1-2-8/h8-9,17H,1-7,15H2
InChIKeyOPSKZAVTHNBWET-UHFFFAOYSA-N
XLogP1.11
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-2-cyclopropyl-3-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]propan-1-ol
CID 64790293
2-Cyclopropyl-2-(cyclopropylamino)-3-[methyl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64825266
2-Cyclopropyl-2-(methylamino)-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64825488
2-Amino-2-cyclopropyl-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64825682
2-Cyclopropyl-3-[ethyl(2,2,2-trifluoroethyl)amino]-2-(methylamino)propan-1-ol
CID 64825685
2-Amino-2-cyclopropyl-3-[ethyl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64825686
2-Cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-(methylamino)propan-1-ol
CID 64825689
2-Cyclopropyl-2-(methylamino)-3-[propyl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64825693
2-Amino-2-cyclopropyl-3-[propyl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64825890
2-Cyclopropyl-3-[methyl(2,2,2-trifluoroethyl)amino]-2-(propylamino)propan-1-ol
CID 64826257
2-Cyclopropyl-2-(ethylamino)-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64826284
2-Cyclopropyl-2-(ethylamino)-3-[ethyl(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 64826287

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol?
The IUPAC name of 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol (CID 64825690) is 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol.
What is the SMILES notation for 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol?
The canonical SMILES for 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol is NC(CO)(CN(CC(F)(F)F)C1CC1)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol?
The InChIKey is OPSKZAVTHNBWET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O/c12-11(13,14)6-16(9-3-4-9)5-10(15,7-17)8-1-2-8/h8-9,17H,1-7,15H2.
What are the key properties of 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol?
2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol has a molecular weight of 252.28 g/mol, XLogP of 1.11, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-1-ol is sourced from PubChem (CID 64825690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).