5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide

C19H19N3O3 — CID 46097081

IUPAC5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide
SMILESCOc1ccccc1-c1onc(C)c1C(=O)NCCc1ccncc1
InChIInChI=1S/C19H19N3O3/c1-13-17(19(23)21-12-9-14-7-10-20-11-8-14)18(25-22-13)15-5-3-4-6-16(15)24-2/h3-8,10-11H,9,12H2,1-2H3,(H,21,23)
InChIKeyRHILVEOFJVPWST-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.03
Rot. Bonds6

About 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide

5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide (PubChem CID 46097081) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide
PubChem CID46097081
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide
SMILESCOc1ccccc1-c1onc(C)c1C(=O)NCCc1ccncc1
InChIInChI=1S/C19H19N3O3/c1-13-17(19(23)21-12-9-14-7-10-20-11-8-14)18(25-22-13)15-5-3-4-6-16(15)24-2/h3-8,10-11H,9,12H2,1-2H3,(H,21,23)
InChIKeyRHILVEOFJVPWST-UHFFFAOYSA-N
XLogP3.03
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-chlorophenyl)-N-[2-(4-fluorophenyl)ethyl]-3-methyl-1,2-oxazole-4-carboxamide
CID 46097141
5-(2-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-3-methyl-1,2-oxazole-4-carboxamide
CID 46096877
N-[(2-chlorophenyl)methyl]-5-(2-methoxyphenyl)-3-methyl-1,2-oxazole-4-carboxamide
CID 46096874
N-[2-(4-methoxyphenyl)ethyl]-3-methyl-5-thiophen-2-yl-1,2-oxazole-4-carboxamide
CID 46093965
5-(2-methoxyphenyl)-3-methyl-N-(oxolan-2-ylmethyl)-1,2-oxazole-4-carboxamide
CID 46096842
5-(2-methoxyphenyl)-3-methyl-N-(1-phenylethyl)-1,2-oxazole-4-carboxamide
CID 46096857
N-[2-(4-aminophenyl)ethyl]-5-(4-methoxyphenyl)-3-methyl-1,2-oxazole-4-carboxamide
CID 46093958
5-(2-chlorophenyl)-N-[2-(1H-imidazol-5-yl)ethyl]-3-methyl-1,2-oxazole-4-carboxamide
CID 92760842
3-methyl-N-(3-phenylpropyl)-5-thiophen-2-yl-1,2-oxazole-4-carboxamide
CID 46096812
1-(2-methoxyphenyl)-3-(2-pyridin-4-ylethyl)urea
CID 974359
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide
CID 46096909
N-[2-(6-methoxy-3-pyridinyl)ethyl]-3-methyl-5-(3,4,5-trimethoxyphenyl)-1,2-oxazole-4-carboxamide
CID 46097417

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide (CID 46097081) is 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide is COc1ccccc1-c1onc(C)c1C(=O)NCCc1ccncc1.
What is the InChIKey of 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
The InChIKey is RHILVEOFJVPWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-13-17(19(23)21-12-9-14-7-10-20-11-8-14)18(25-22-13)15-5-3-4-6-16(15)24-2/h3-8,10-11H,9,12H2,1-2H3,(H,21,23).
What are the key properties of 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide?
5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-3-methyl-N-(2-pyridin-4-ylethyl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 46097081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).