2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide

C10H12F3N3O2 — CID 113392286

IUPAC2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide
SMILESCc1ccc(O)c(NC(=O)C(C)(N)C(F)(F)F)n1
InChIInChI=1S/C10H12F3N3O2/c1-5-3-4-6(17)7(15-5)16-8(18)9(2,14)10(11,12)13/h3-4,17H,14H2,1-2H3,(H,15,16,18)
InChIKeyPLVBLQPTRFVADS-UHFFFAOYSA-N
MW263.22 g/mol
LogP1.31
Rot. Bonds2

About 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide

2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide (PubChem CID 113392286) 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-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide
PubChem CID113392286
Molecular FormulaC10H12F3N3O2
Molecular Weight263.22 g/mol
Exact Mass263.09
IUPAC Name2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide
SMILESCc1ccc(O)c(NC(=O)C(C)(N)C(F)(F)F)n1
InChIInChI=1S/C10H12F3N3O2/c1-5-3-4-6(17)7(15-5)16-8(18)9(2,14)10(11,12)13/h3-4,17H,14H2,1-2H3,(H,15,16,18)
InChIKeyPLVBLQPTRFVADS-UHFFFAOYSA-N
XLogP1.31
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide?
The IUPAC name of 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide (CID 113392286) is 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide.
What is the SMILES notation for 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide?
The canonical SMILES for 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide is Cc1ccc(O)c(NC(=O)C(C)(N)C(F)(F)F)n1.
What is the InChIKey of 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide?
The InChIKey is PLVBLQPTRFVADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O2/c1-5-3-4-6(17)7(15-5)16-8(18)9(2,14)10(11,12)13/h3-4,17H,14H2,1-2H3,(H,15,16,18).
What are the key properties of 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide?
2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide has a molecular weight of 263.22 g/mol, XLogP of 1.31, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,3,3-trifluoro-N-(3-hydroxy-6-methyl-2-pyridinyl)-2-methylpropanamide is sourced from PubChem (CID 113392286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).