N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide

C10H7F2N3O2 — CID 103097724

IUPACN-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1ncoc1C(=O)Nc1ccc(F)nc1F
InChIInChI=1S/C10H7F2N3O2/c1-5-8(17-4-13-5)10(16)14-6-2-3-7(11)15-9(6)12/h2-4H,1H3,(H,14,16)
InChIKeyWFJOVNQTQRQOPX-UHFFFAOYSA-N
MW239.18 g/mol
LogP1.91
Rot. Bonds2

About N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide

N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide (PubChem CID 103097724) has the molecular formula C10H7F2N3O2 and a molecular weight of 239.18 g/mol. Its IUPAC name is N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide
PubChem CID103097724
Molecular FormulaC10H7F2N3O2
Molecular Weight239.18 g/mol
Exact Mass239.05
IUPAC NameN-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1ncoc1C(=O)Nc1ccc(F)nc1F
InChIInChI=1S/C10H7F2N3O2/c1-5-8(17-4-13-5)10(16)14-6-2-3-7(11)15-9(6)12/h2-4H,1H3,(H,14,16)
InChIKeyWFJOVNQTQRQOPX-UHFFFAOYSA-N
XLogP1.91
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.18
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,2-oxazole-5-carboxamide
CID 103098068
N-(2,6-difluoro-3-pyridinyl)-4-methylbenzamide
CID 103097809
N-(2,6-difluoro-3-pyridinyl)-4-methylthiadiazole-5-carboxamide
CID 103098047
N-(4-bromo-2,5-difluorophenyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 113330185
N-(2-cyano-3-fluorophenyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 79487939
N-(5-bromo-4-fluoro-2-methylphenyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 103278131
N-(2-bromo-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 103819414
methyl 5-methyl-2-[(4-methyl-1,3-oxazole-5-carbonyl)amino]benzoate
CID 79479514
4-methyl-N-pyrimidin-2-yl-1,3-oxazole-5-carboxamide
CID 110686212
N-(2,6-dimethyl-3-pyridinyl)-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide
CID 138026513
N-(2,6-difluoro-3-pyridinyl)-1,3-thiazole-4-carboxamide
CID 103097885
N-(5-bromo-2-chloro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 102979254

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide (CID 103097724) is N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide is Cc1ncoc1C(=O)Nc1ccc(F)nc1F.
What is the InChIKey of N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide?
The InChIKey is WFJOVNQTQRQOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2N3O2/c1-5-8(17-4-13-5)10(16)14-6-2-3-7(11)15-9(6)12/h2-4H,1H3,(H,14,16).
What are the key properties of N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide?
N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 239.18 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluoro-3-pyridinyl)-4-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 103097724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).