2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

C12H16F3N3O2 — CID 62814436

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C12H16F3N3O2/c1-8(2)18(7-12(13,14)15)11(20)6-17-5-9(16)3-4-10(17)19/h3-5,8H,6-7,16H2,1-2H3
InChIKeyAUWJPYGXZIDQOE-UHFFFAOYSA-N
MW291.27 g/mol
LogP1.23
Rot. Bonds4

About 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 62814436) has the molecular formula C12H16F3N3O2 and a molecular weight of 291.27 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID62814436
Molecular FormulaC12H16F3N3O2
Molecular Weight291.27 g/mol
Exact Mass291.12
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCC(C)N(CC(F)(F)F)C(=O)Cn1cc(N)ccc1=O
InChIInChI=1S/C12H16F3N3O2/c1-8(2)18(7-12(13,14)15)11(20)6-17-5-9(16)3-4-10(17)19/h3-5,8H,6-7,16H2,1-2H3
InChIKeyAUWJPYGXZIDQOE-UHFFFAOYSA-N
XLogP1.23
TPSA68.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.27
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 62814436) is 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is CC(C)N(CC(F)(F)F)C(=O)Cn1cc(N)ccc1=O.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is AUWJPYGXZIDQOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F3N3O2/c1-8(2)18(7-12(13,14)15)11(20)6-17-5-9(16)3-4-10(17)19/h3-5,8H,6-7,16H2,1-2H3.
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 291.27 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 62814436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).