N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide

C17H15N3O4 — CID 4058781

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cccn(OCc3ccccc3)c2=O)no1
InChIInChI=1S/C17H15N3O4/c1-12-10-15(19-24-12)18-16(21)14-8-5-9-20(17(14)22)23-11-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,18,19,21)
InChIKeyZHJAYLDIPSOWAP-UHFFFAOYSA-N
MW325.32 g/mol
LogP2.03
Rot. Bonds5

About N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide

N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide (PubChem CID 4058781) has the molecular formula C17H15N3O4 and a molecular weight of 325.32 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
PubChem CID4058781
Molecular FormulaC17H15N3O4
Molecular Weight325.32 g/mol
Exact Mass325.11
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cccn(OCc3ccccc3)c2=O)no1
InChIInChI=1S/C17H15N3O4/c1-12-10-15(19-24-12)18-16(21)14-8-5-9-20(17(14)22)23-11-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,18,19,21)
InChIKeyZHJAYLDIPSOWAP-UHFFFAOYSA-N
XLogP2.03
TPSA86.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.32
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide (CID 4058781) is N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide is Cc1cc(NC(=O)c2cccn(OCc3ccccc3)c2=O)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
The InChIKey is ZHJAYLDIPSOWAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O4/c1-12-10-15(19-24-12)18-16(21)14-8-5-9-20(17(14)22)23-11-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,18,19,21).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide has a molecular weight of 325.32 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-oxo-1-phenylmethoxypyridine-3-carboxamide is sourced from PubChem (CID 4058781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).