2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

C11H21F3N2O2 — CID 119052530

IUPAC2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC(C)(C)C(C)NCC(=O)N(C)CC(F)(F)F
InChIInChI=1S/C11H21F3N2O2/c1-8(10(2,3)18-5)15-6-9(17)16(4)7-11(12,13)14/h8,15H,6-7H2,1-5H3
InChIKeyMHKKHRPBANGVQR-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.41
Rot. Bonds6

About 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 119052530) has the molecular formula C11H21F3N2O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID119052530
Molecular FormulaC11H21F3N2O2
Molecular Weight270.29 g/mol
Exact Mass270.16
IUPAC Name2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC(C)(C)C(C)NCC(=O)N(C)CC(F)(F)F
InChIInChI=1S/C11H21F3N2O2/c1-8(10(2,3)18-5)15-6-9(17)16(4)7-11(12,13)14/h8,15H,6-7H2,1-5H3
InChIKeyMHKKHRPBANGVQR-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (CID 119052530) is 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is COC(C)(C)C(C)NCC(=O)N(C)CC(F)(F)F.
What is the InChIKey of 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is MHKKHRPBANGVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O2/c1-8(10(2,3)18-5)15-6-9(17)16(4)7-11(12,13)14/h8,15H,6-7H2,1-5H3.
What are the key properties of 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 270.29 g/mol, XLogP of 1.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxy-3-methylbutan-2-yl)amino]-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 119052530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).