2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide

C11H10F3N5O2 — CID 79875484

IUPAC2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1noc(CNc2nc(C(F)(F)F)ccc2C(N)=O)n1
InChIInChI=1S/C11H10F3N5O2/c1-5-17-8(21-19-5)4-16-10-6(9(15)20)2-3-7(18-10)11(12,13)14/h2-3H,4H2,1H3,(H2,15,20)(H,16,18)
InChIKeyVGEMGOLKROGMPW-UHFFFAOYSA-N
MW301.23 g/mol
LogP1.50
Rot. Bonds4

About 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide

2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 79875484) has the molecular formula C11H10F3N5O2 and a molecular weight of 301.23 g/mol. Its IUPAC name is 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID79875484
Molecular FormulaC11H10F3N5O2
Molecular Weight301.23 g/mol
Exact Mass301.08
IUPAC Name2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1noc(CNc2nc(C(F)(F)F)ccc2C(N)=O)n1
InChIInChI=1S/C11H10F3N5O2/c1-5-17-8(21-19-5)4-16-10-6(9(15)20)2-3-7(18-10)11(12,13)14/h2-3H,4H2,1H3,(H2,15,20)(H,16,18)
InChIKeyVGEMGOLKROGMPW-UHFFFAOYSA-N
XLogP1.50
TPSA106.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.23
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 106277197
2-(2-methylpropylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79869612
2-(4-methylpentylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79868797
2-[[3-(dimethylamino)-3-oxopropyl]amino]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79875486
2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxylic acid
CID 106409489
2-(2-methoxyethylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79869543
2-[(2-hydroxy-2-methylbutyl)amino]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79876734
2-(2,3-dimethylbutylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79868802
2-(3-aminopropylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79877730
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(trifluoromethyl)pyridin-2-amine
CID 54903289
2-(hexylamino)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79869081
2-[(3-hydroxy-2-methylpropyl)amino]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79869147

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide (CID 79875484) is 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide is Cc1noc(CNc2nc(C(F)(F)F)ccc2C(N)=O)n1.
What is the InChIKey of 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is VGEMGOLKROGMPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N5O2/c1-5-17-8(21-19-5)4-16-10-6(9(15)20)2-3-7(18-10)11(12,13)14/h2-3H,4H2,1H3,(H2,15,20)(H,16,18).
What are the key properties of 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide?
2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 301.23 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 79875484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).