5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide

C19H18N2O3 — CID 41098465

IUPAC5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)N[C@@H](C)c2ccccc2)no1
InChIInChI=1S/C19H18N2O3/c1-13(14-8-4-3-5-9-14)20-19(22)16-12-18(24-21-16)15-10-6-7-11-17(15)23-2/h3-13H,1-2H3,(H,20,22)/t13-/m0/s1
InChIKeySRKVLOFTYWDKDP-ZDUSSCGKSA-N
MW322.36 g/mol
LogP3.84
Rot. Bonds5

About 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide

5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide (PubChem CID 41098465) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide
PubChem CID41098465
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)N[C@@H](C)c2ccccc2)no1
InChIInChI=1S/C19H18N2O3/c1-13(14-8-4-3-5-9-14)20-19(22)16-12-18(24-21-16)15-10-6-7-11-17(15)23-2/h3-13H,1-2H3,(H,20,22)/t13-/m0/s1
InChIKeySRKVLOFTYWDKDP-ZDUSSCGKSA-N
XLogP3.84
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide
CID 42461695
5-(2-methoxyphenyl)-3-methyl-N-(1-phenylethyl)-1,2-oxazole-4-carboxamide
CID 46096857
N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 129377025
5-(2-methoxyphenyl)-N-[3-(phenylcarbamoylamino)phenyl]-1,2-oxazole-3-carboxamide
CID 46417646
N-[1-(2,5-dimethoxyphenyl)ethyl]-5-(2-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 55637870
N-[2-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 46963594
5-(2-methoxyphenyl)-N-(3-methylphenyl)-1,2-oxazole-3-carboxamide
CID 46417466
N-[(1R)-1-(3-methoxyphenyl)ethyl]-5-(3-methylphenyl)-1,2-oxazole-3-carboxamide
CID 46087211
5-(2-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]-1,2-oxazole-3-carboxamide
CID 15988743
5-methoxy-N-[(1S)-1-phenylethyl]quinoline-2-carboxamide
CID 11312803
N-[(1S)-1-(4-methylsulfonylphenyl)ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 31883285
5-(2-methoxyphenyl)-N-[(2S)-2-methyl-3-pyrazol-1-ylpropyl]-1,2-oxazole-3-carboxamide
CID 94809649

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide (CID 41098465) is 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide is COc1ccccc1-c1cc(C(=O)N[C@@H](C)c2ccccc2)no1.
What is the InChIKey of 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is SRKVLOFTYWDKDP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-13(14-8-4-3-5-9-14)20-19(22)16-12-18(24-21-16)15-10-6-7-11-17(15)23-2/h3-13H,1-2H3,(H,20,22)/t13-/m0/s1.
What are the key properties of 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide?
5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 322.36 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 41098465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).