3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide

C16H13N3O3 — CID 90574213

IUPAC3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide
SMILESO=C(Nc1cccnc1)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C16H13N3O3/c20-16(18-13-7-4-8-17-10-13)14-9-15(19-22-14)21-11-12-5-2-1-3-6-12/h1-10H,11H2,(H,18,20)
InChIKeyWCCVRNRETHRQJK-UHFFFAOYSA-N
MW295.30 g/mol
LogP2.90
Rot. Bonds5

About 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide

3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide (PubChem CID 90574213) has the molecular formula C16H13N3O3 and a molecular weight of 295.30 g/mol. Its IUPAC name is 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide
PubChem CID90574213
Molecular FormulaC16H13N3O3
Molecular Weight295.30 g/mol
Exact Mass295.10
IUPAC Name3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide
SMILESO=C(Nc1cccnc1)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C16H13N3O3/c20-16(18-13-7-4-8-17-10-13)14-9-15(19-22-14)21-11-12-5-2-1-3-6-12/h1-10H,11H2,(H,18,20)
InChIKeyWCCVRNRETHRQJK-UHFFFAOYSA-N
XLogP2.90
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dimethylphenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574190
N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574114
3-phenylmethoxy-N-[3-(tetrazol-1-yl)phenyl]-1,2-oxazole-5-carboxamide
CID 146021794
N-(2-phenoxyethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 71802527
N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574182
3-phenylmethoxy-N-[4-(tetrazol-1-yl)phenyl]-1,2-oxazole-5-carboxamide
CID 90574013
3-phenylmethoxy-N-prop-2-enyl-1,2-oxazole-5-carboxamide
CID 90574076
N-(2-methylquinolin-4-yl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574215
N-(3-methoxypropyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574079
N-(6-phenylmethoxy-3-pyridinyl)-3-(pyridin-3-ylmethoxy)benzamide
CID 55880084
3-oxo-2-phenylmethoxy-N-pyridin-3-ylcyclohexa-1,5-diene-1-carboxamide
CID 67108039
N-(4-phenylmethoxyphenyl)-N'-pyridin-3-ylpentanediamide
CID 51362775

Frequently Asked Questions

What is the IUPAC name of 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide (CID 90574213) is 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide is O=C(Nc1cccnc1)c1cc(OCc2ccccc2)no1.
What is the InChIKey of 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide?
The InChIKey is WCCVRNRETHRQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O3/c20-16(18-13-7-4-8-17-10-13)14-9-15(19-22-14)21-11-12-5-2-1-3-6-12/h1-10H,11H2,(H,18,20).
What are the key properties of 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide?
3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide has a molecular weight of 295.30 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 90574213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).