N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide

C17H12Cl2N2O3 — CID 90574182

IUPACN-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1Cl)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C17H12Cl2N2O3/c18-12-6-7-13(19)14(8-12)20-17(22)15-9-16(21-24-15)23-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,20,22)
InChIKeyUSFYQNVRIAINCD-UHFFFAOYSA-N
MW363.20 g/mol
LogP4.81
Rot. Bonds5

About N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide

N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide (PubChem CID 90574182) has the molecular formula C17H12Cl2N2O3 and a molecular weight of 363.20 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
PubChem CID90574182
Molecular FormulaC17H12Cl2N2O3
Molecular Weight363.20 g/mol
Exact Mass362.02
IUPAC NameN-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1Cl)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C17H12Cl2N2O3/c18-12-6-7-13(19)14(8-12)20-17(22)15-9-16(21-24-15)23-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,20,22)
InChIKeyUSFYQNVRIAINCD-UHFFFAOYSA-N
XLogP4.81
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.20
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylquinolin-4-yl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574215
N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574114
3-phenylmethoxy-N-prop-2-enyl-1,2-oxazole-5-carboxamide
CID 90574076
N-(2,5-dichlorophenyl)benzamide;hydroiodide
CID 175991469
N-(5-chloro-2-methoxyphenyl)-3-methoxy-1,2-oxazole-5-carboxamide
CID 71802469
N-(3-methoxypropyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574079
3-phenylmethoxy-N-[4-(tetrazol-1-yl)phenyl]-1,2-oxazole-5-carboxamide
CID 90574013
5-[benzyl(methyl)amino]-N-(2,5-dichlorophenyl)pyridine-2-carboxamide
CID 109189327
3-phenylmethoxy-N-[3-(tetrazol-1-yl)phenyl]-1,2-oxazole-5-carboxamide
CID 146021794
[4-[(2,5-dichlorophenyl)carbamoyl]phenyl] (E)-3-(4-phenylmethoxyphenyl)prop-2-enoate
CID 19181830
N-(oxolan-2-ylmethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574102
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-2-phenylacetamide
CID 2449630

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
The IUPAC name of N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide (CID 90574182) is N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide is O=C(Nc1cc(Cl)ccc1Cl)c1cc(OCc2ccccc2)no1.
What is the InChIKey of N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
The InChIKey is USFYQNVRIAINCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O3/c18-12-6-7-13(19)14(8-12)20-17(22)15-9-16(21-24-15)23-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,20,22).
What are the key properties of N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide has a molecular weight of 363.20 g/mol, XLogP of 4.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 90574182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).