2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

C8H15F3N2O3 — CID 66186009

IUPAC2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(O)(CO)CNCC(=O)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O3/c1-7(16,5-14)3-12-2-6(15)13-4-8(9,10)11/h12,14,16H,2-5H2,1H3,(H,13,15)
InChIKeyGKWKLPJMAQKJIV-UHFFFAOYSA-N
MW244.21 g/mol
LogP-1.00
Rot. Bonds6

About 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 66186009) has the molecular formula C8H15F3N2O3 and a molecular weight of 244.21 g/mol. Its IUPAC name is 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID66186009
Molecular FormulaC8H15F3N2O3
Molecular Weight244.21 g/mol
Exact Mass244.10
IUPAC Name2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(O)(CO)CNCC(=O)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O3/c1-7(16,5-14)3-12-2-6(15)13-4-8(9,10)11/h12,14,16H,2-5H2,1H3,(H,13,15)
InChIKeyGKWKLPJMAQKJIV-UHFFFAOYSA-N
XLogP-1.00
TPSA81.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.21
LogP ≤ 5-1.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 66186009) is 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is CC(O)(CO)CNCC(=O)NCC(F)(F)F.
What is the InChIKey of 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is GKWKLPJMAQKJIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O3/c1-7(16,5-14)3-12-2-6(15)13-4-8(9,10)11/h12,14,16H,2-5H2,1H3,(H,13,15).
What are the key properties of 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 244.21 g/mol, XLogP of -1.00, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,3-dihydroxy-2-methylpropyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 66186009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).