2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide

C10H12F3N3O2 — CID 79797297

IUPAC2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide
SMILESCOc1ncccc1NC(=O)C(C)(N)C(F)(F)F
InChIInChI=1S/C10H12F3N3O2/c1-9(14,10(11,12)13)8(17)16-6-4-3-5-15-7(6)18-2/h3-5H,14H2,1-2H3,(H,16,17)
InChIKeyAOAZUFRPBKLKIS-UHFFFAOYSA-N
MW263.22 g/mol
LogP1.31
Rot. Bonds3

About 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide

2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide (PubChem CID 79797297) has the molecular formula C10H12F3N3O2 and a molecular weight of 263.22 g/mol. Its IUPAC name is 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide
PubChem CID79797297
Molecular FormulaC10H12F3N3O2
Molecular Weight263.22 g/mol
Exact Mass263.09
IUPAC Name2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide
SMILESCOc1ncccc1NC(=O)C(C)(N)C(F)(F)F
InChIInChI=1S/C10H12F3N3O2/c1-9(14,10(11,12)13)8(17)16-6-4-3-5-15-7(6)18-2/h3-5H,14H2,1-2H3,(H,16,17)
InChIKeyAOAZUFRPBKLKIS-UHFFFAOYSA-N
XLogP1.31
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide?
The IUPAC name of 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide (CID 79797297) is 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide.
What is the SMILES notation for 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide?
The canonical SMILES for 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide is COc1ncccc1NC(=O)C(C)(N)C(F)(F)F.
What is the InChIKey of 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide?
The InChIKey is AOAZUFRPBKLKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O2/c1-9(14,10(11,12)13)8(17)16-6-4-3-5-15-7(6)18-2/h3-5H,14H2,1-2H3,(H,16,17).
What are the key properties of 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide?
2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide has a molecular weight of 263.22 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,3,3-trifluoro-N-(2-methoxy-3-pyridinyl)-2-methylpropanamide is sourced from PubChem (CID 79797297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).