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

C19H18N2O3 — CID 90574114

IUPACN-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
SMILESO=C(NCCc1ccccc1)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C19H18N2O3/c22-19(20-12-11-15-7-3-1-4-8-15)17-13-18(21-24-17)23-14-16-9-5-2-6-10-16/h1-10,13H,11-12,14H2,(H,20,22)
InChIKeyJMHYRKJDQUSHRA-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.23
Rot. Bonds7

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

N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide (PubChem CID 90574114) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
PubChem CID90574114
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
SMILESO=C(NCCc1ccccc1)c1cc(OCc2ccccc2)no1
InChIInChI=1S/C19H18N2O3/c22-19(20-12-11-15-7-3-1-4-8-15)17-13-18(21-24-17)23-14-16-9-5-2-6-10-16/h1-10,13H,11-12,14H2,(H,20,22)
InChIKeyJMHYRKJDQUSHRA-UHFFFAOYSA-N
XLogP3.23
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-phenoxyethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 71802527
N-(3-methoxypropyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574079
N-[2-(1H-indol-3-yl)ethyl]-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574118
3-phenylmethoxy-N-prop-2-enyl-1,2-oxazole-5-carboxamide
CID 90574076
N-(3,4-dimethylphenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574190
N-(oxolan-2-ylmethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574102
3-phenylmethoxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-1,2-oxazole-5-carboxamide
CID 90574012
3-phenylmethoxy-N-pyridin-3-yl-1,2-oxazole-5-carboxamide
CID 90574213
N-(2-phenylethyl)-2-phenylmethoxyquinoline-4-carboxamide
CID 22577997
N-(2,5-dichlorophenyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574182
N-(2-methylquinolin-4-yl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide
CID 90574215
3-phenylmethoxy-N-[4-(tetrazol-1-yl)phenyl]-1,2-oxazole-5-carboxamide
CID 90574013

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
The IUPAC name of N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide (CID 90574114) is N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide is O=C(NCCc1ccccc1)c1cc(OCc2ccccc2)no1.
What is the InChIKey of N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
The InChIKey is JMHYRKJDQUSHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c22-19(20-12-11-15-7-3-1-4-8-15)17-13-18(21-24-17)23-14-16-9-5-2-6-10-16/h1-10,13H,11-12,14H2,(H,20,22).
What are the key properties of N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide?
N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 3.23, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-3-phenylmethoxy-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 90574114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).