N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide

C18H17N3O2 — CID 155597416

IUPACN-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide
SMILESCc1noc(C)c1-c1ccc(NC(=O)Cc2ccccc2)nc1
InChIInChI=1S/C18H17N3O2/c1-12-18(13(2)23-21-12)15-8-9-16(19-11-15)20-17(22)10-14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3,(H,19,20,22)
InChIKeyFEJUZVZYTJYKNZ-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.53
Rot. Bonds4

About N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide

N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide (PubChem CID 155597416) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide
PubChem CID155597416
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide
SMILESCc1noc(C)c1-c1ccc(NC(=O)Cc2ccccc2)nc1
InChIInChI=1S/C18H17N3O2/c1-12-18(13(2)23-21-12)15-8-9-16(19-11-15)20-17(22)10-14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3,(H,19,20,22)
InChIKeyFEJUZVZYTJYKNZ-UHFFFAOYSA-N
XLogP3.53
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide?
The IUPAC name of N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide (CID 155597416) is N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide.
What is the SMILES notation for N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide?
The canonical SMILES for N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide is Cc1noc(C)c1-c1ccc(NC(=O)Cc2ccccc2)nc1.
What is the InChIKey of N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide?
The InChIKey is FEJUZVZYTJYKNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-12-18(13(2)23-21-12)15-8-9-16(19-11-15)20-17(22)10-14-6-4-3-5-7-14/h3-9,11H,10H2,1-2H3,(H,19,20,22).
What are the key properties of N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide?
N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide has a molecular weight of 307.35 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-pyridinyl]-2-phenylacetamide is sourced from PubChem (CID 155597416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).