2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide

C17H14FN3O2 — CID 155162171

IUPAC2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide
SMILESCc1ccc(-c2cc(C(=O)Nc3ccon3)c(F)cc2C)cn1
InChIInChI=1S/C17H14FN3O2/c1-10-7-15(18)14(17(22)20-16-5-6-23-21-16)8-13(10)12-4-3-11(2)19-9-12/h3-9H,1-2H3,(H,20,21,22)
InChIKeyGHHVARWVPLCZRY-UHFFFAOYSA-N
MW311.32 g/mol
LogP3.74
Rot. Bonds3

About 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide

2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide (PubChem CID 155162171) has the molecular formula C17H14FN3O2 and a molecular weight of 311.32 g/mol. Its IUPAC name is 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide
PubChem CID155162171
Molecular FormulaC17H14FN3O2
Molecular Weight311.32 g/mol
Exact Mass311.11
IUPAC Name2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide
SMILESCc1ccc(-c2cc(C(=O)Nc3ccon3)c(F)cc2C)cn1
InChIInChI=1S/C17H14FN3O2/c1-10-7-15(18)14(17(22)20-16-5-6-23-21-16)8-13(10)12-4-3-11(2)19-9-12/h3-9H,1-2H3,(H,20,21,22)
InChIKeyGHHVARWVPLCZRY-UHFFFAOYSA-N
XLogP3.74
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide?
The IUPAC name of 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide (CID 155162171) is 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide is Cc1ccc(-c2cc(C(=O)Nc3ccon3)c(F)cc2C)cn1.
What is the InChIKey of 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide?
The InChIKey is GHHVARWVPLCZRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O2/c1-10-7-15(18)14(17(22)20-16-5-6-23-21-16)8-13(10)12-4-3-11(2)19-9-12/h3-9H,1-2H3,(H,20,21,22).
What are the key properties of 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide?
2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide has a molecular weight of 311.32 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-5-(6-methyl-3-pyridinyl)-N-(1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 155162171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).