2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide

C17H14ClN3O2 — CID 16878710

IUPAC2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cccc(NC(=O)Cc2cc(-c3ccc(Cl)cc3)on2)n1
InChIInChI=1S/C17H14ClN3O2/c1-11-3-2-4-16(19-11)20-17(22)10-14-9-15(23-21-14)12-5-7-13(18)8-6-12/h2-9H,10H2,1H3,(H,19,20,22)
InChIKeyQNHBRPXUKXCPPC-UHFFFAOYSA-N
MW327.77 g/mol
LogP3.88
Rot. Bonds4

About 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide

2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide (PubChem CID 16878710) has the molecular formula C17H14ClN3O2 and a molecular weight of 327.77 g/mol. Its IUPAC name is 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide
PubChem CID16878710
Molecular FormulaC17H14ClN3O2
Molecular Weight327.77 g/mol
Exact Mass327.08
IUPAC Name2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cccc(NC(=O)Cc2cc(-c3ccc(Cl)cc3)on2)n1
InChIInChI=1S/C17H14ClN3O2/c1-11-3-2-4-16(19-11)20-17(22)10-14-9-15(23-21-14)12-5-7-13(18)8-6-12/h2-9H,10H2,1H3,(H,19,20,22)
InChIKeyQNHBRPXUKXCPPC-UHFFFAOYSA-N
XLogP3.88
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.77
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide (CID 16878710) is 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide is Cc1cccc(NC(=O)Cc2cc(-c3ccc(Cl)cc3)on2)n1.
What is the InChIKey of 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide?
The InChIKey is QNHBRPXUKXCPPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O2/c1-11-3-2-4-16(19-11)20-17(22)10-14-9-15(23-21-14)12-5-7-13(18)8-6-12/h2-9H,10H2,1H3,(H,19,20,22).
What are the key properties of 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide?
2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide has a molecular weight of 327.77 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]-N-(6-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 16878710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).