5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide

C18H18N2O3S — CID 42461695

IUPAC5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)N[C@H](C)Cc2cccs2)no1
InChIInChI=1S/C18H18N2O3S/c1-12(10-13-6-5-9-24-13)19-18(21)15-11-17(23-20-15)14-7-3-4-8-16(14)22-2/h3-9,11-12H,10H2,1-2H3,(H,19,21)/t12-/m1/s1
InChIKeyWTWQBLUYOAXHQD-GFCCVEGCSA-N
MW342.42 g/mol
LogP3.77
Rot. Bonds6

About 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide

5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide (PubChem CID 42461695) has the molecular formula C18H18N2O3S and a molecular weight of 342.42 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide
PubChem CID42461695
Molecular FormulaC18H18N2O3S
Molecular Weight342.42 g/mol
Exact Mass342.10
IUPAC Name5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)N[C@H](C)Cc2cccs2)no1
InChIInChI=1S/C18H18N2O3S/c1-12(10-13-6-5-9-24-13)19-18(21)15-11-17(23-20-15)14-7-3-4-8-16(14)22-2/h3-9,11-12H,10H2,1-2H3,(H,19,21)/t12-/m1/s1
InChIKeyWTWQBLUYOAXHQD-GFCCVEGCSA-N
XLogP3.77
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2-oxazole-3-carboxamide
CID 41098465
5-(2,5-dimethoxyphenyl)-N-(1-methoxypropan-2-yl)-1,2-oxazole-3-carboxamide
CID 3674837
N-[(1R)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-5-(2-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 129377025
N-(1-hydroxypropan-2-yl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 43418627
(4S)-4-[[5-(2,5-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino]pentanoic acid
CID 97338789
(4R)-4-[[5-(2,5-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino]pentanoic acid
CID 97338790
methane;N-(1-thiophen-2-ylpropan-2-yl)benzamide
CID 159530206
5-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 5308138
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
5-(ethylamino)-N-(1-thiophen-2-ylpropan-2-yl)pyridine-2-carboxamide
CID 104641309
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-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide (CID 42461695) is 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide is COc1ccccc1-c1cc(C(=O)N[C@H](C)Cc2cccs2)no1.
What is the InChIKey of 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide?
The InChIKey is WTWQBLUYOAXHQD-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H18N2O3S/c1-12(10-13-6-5-9-24-13)19-18(21)15-11-17(23-20-15)14-7-3-4-8-16(14)22-2/h3-9,11-12H,10H2,1-2H3,(H,19,21)/t12-/m1/s1.
What are the key properties of 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide?
5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide has a molecular weight of 342.42 g/mol, XLogP of 3.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-N-[(2R)-1-thiophen-2-ylpropan-2-yl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 42461695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).