1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol

C11H21F3N2O — CID 64821573

IUPAC1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol
SMILESCC(O)(CN)CCCN(CC(F)(F)F)C1CC1
InChIInChI=1S/C11H21F3N2O/c1-10(17,7-15)5-2-6-16(9-3-4-9)8-11(12,13)14/h9,17H,2-8,15H2,1H3
InChIKeyWUVCCJZDWLUMBZ-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.50
Rot. Bonds7

About 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol

1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol (PubChem CID 64821573) has the molecular formula C11H21F3N2O and a molecular weight of 254.30 g/mol. Its IUPAC name is 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol.

Molecular Properties

Compound Name1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol
PubChem CID64821573
Molecular FormulaC11H21F3N2O
Molecular Weight254.30 g/mol
Exact Mass254.16
IUPAC Name1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol
SMILESCC(O)(CN)CCCN(CC(F)(F)F)C1CC1
InChIInChI=1S/C11H21F3N2O/c1-10(17,7-15)5-2-6-16(9-3-4-9)8-11(12,13)14/h9,17H,2-8,15H2,1H3
InChIKeyWUVCCJZDWLUMBZ-UHFFFAOYSA-N
XLogP1.50
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol?
The IUPAC name of 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol (CID 64821573) is 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol.
What is the SMILES notation for 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol?
The canonical SMILES for 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol is CC(O)(CN)CCCN(CC(F)(F)F)C1CC1.
What is the InChIKey of 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol?
The InChIKey is WUVCCJZDWLUMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O/c1-10(17,7-15)5-2-6-16(9-3-4-9)8-11(12,13)14/h9,17H,2-8,15H2,1H3.
What are the key properties of 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol?
1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol has a molecular weight of 254.30 g/mol, XLogP of 1.50, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-5-[cyclopropyl(2,2,2-trifluoroethyl)amino]-2-methylpentan-2-ol is sourced from PubChem (CID 64821573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).