2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

C8H15F3N2O3 — CID 60686227

IUPAC2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CN(CCO)CCO)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O3/c9-8(10,11)6-12-7(16)5-13(1-3-14)2-4-15/h14-15H,1-6H2,(H,12,16)
InChIKeyDWBRWMJQYLISGG-UHFFFAOYSA-N
MW244.21 g/mol
LogP-1.05
Rot. Bonds7

About 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 60686227) has the molecular formula C8H15F3N2O3 and a molecular weight of 244.21 g/mol. Its IUPAC name is 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID60686227
Molecular FormulaC8H15F3N2O3
Molecular Weight244.21 g/mol
Exact Mass244.10
IUPAC Name2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CN(CCO)CCO)NCC(F)(F)F
InChIInChI=1S/C8H15F3N2O3/c9-8(10,11)6-12-7(16)5-13(1-3-14)2-4-15/h14-15H,1-6H2,(H,12,16)
InChIKeyDWBRWMJQYLISGG-UHFFFAOYSA-N
XLogP-1.05
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.21
LogP ≤ 5-1.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[bis(2-methoxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 78807325
2-[2-aminoethyl(propyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 61492715
2-[2-aminoethyl(2-methoxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 113468481
2-[bis(2-hydroxyethyl)amino]-N-propylacetamide
CID 60686308
4-[[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]amino]butanoic acid
CID 107485886
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 78787831
ethyl 4-[[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]amino]butanoate
CID 103864941
2-[3-hydroxybutyl(methyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 111488551
methyl 4-[[2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetyl]amino]butanoate
CID 103864914
2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide
CID 60686353
2-[butyl(2-hydroxyethyl)amino]-N-(2-hydroxyethyl)acetamide
CID 61446926
N-methyl-3-oxo-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]butanamide
CID 54876595

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 60686227) is 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is O=C(CN(CCO)CCO)NCC(F)(F)F.
What is the InChIKey of 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is DWBRWMJQYLISGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O3/c9-8(10,11)6-12-7(16)5-13(1-3-14)2-4-15/h14-15H,1-6H2,(H,12,16).
What are the key properties of 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 244.21 g/mol, XLogP of -1.05, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-hydroxyethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 60686227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).