N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide

C20H20N2O3 — CID 58033132

IUPACN-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide
SMILESCOc1ccccc1Cc1cnc(NC(=O)C(C)c2ccccc2)o1
InChIInChI=1S/C20H20N2O3/c1-14(15-8-4-3-5-9-15)19(23)22-20-21-13-17(25-20)12-16-10-6-7-11-18(16)24-2/h3-11,13-14H,12H2,1-2H3,(H,21,22,23)
InChIKeyRNPKWGTVSIJOPN-UHFFFAOYSA-N
MW336.39 g/mol
LogP4.02
Rot. Bonds6

About N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide

N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide (PubChem CID 58033132) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide.

Molecular Properties

Compound NameN-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide
PubChem CID58033132
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC NameN-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide
SMILESCOc1ccccc1Cc1cnc(NC(=O)C(C)c2ccccc2)o1
InChIInChI=1S/C20H20N2O3/c1-14(15-8-4-3-5-9-15)19(23)22-20-21-13-17(25-20)12-16-10-6-7-11-18(16)24-2/h3-11,13-14H,12H2,1-2H3,(H,21,22,23)
InChIKeyRNPKWGTVSIJOPN-UHFFFAOYSA-N
XLogP4.02
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[(2-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-3-methyl-2-phenylpentanamide
CID 58033028
2-[1-[(2-methoxyphenyl)methyl]isoquinolin-4-yl]propanoic acid
CID 67425908
2-[2-[(2-methoxyphenyl)methyl]-1,3-oxazol-5-yl]propan-1-ol
CID 115086826
(2R)-N-(2,4-dimethoxyphenyl)-2-phenylpropanamide
CID 97038174
N-(4,6-dimethoxypyrimidin-2-yl)-2-phenylpropanamide
CID 71620621
(2S)-2-(benzhydrylamino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 9445893
N-[[5-[(2-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 62139060
2-[2-(2-methoxyphenyl)ethylamino]-N-(methylcarbamoyl)-2-phenylacetamide
CID 17485051
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-phenylpropanamide
CID 22026290
(1R,2S)-2-[(2-methoxyphenyl)methylamino]-1-phenylpropan-1-ol
CID 54310024
N-(2-phenoxyphenyl)-2-phenylpropanamide
CID 2933761
1-[(2-methoxyphenyl)methyl]-3-(2-phenylpropyl)urea
CID 51291119

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide?
The IUPAC name of N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide (CID 58033132) is N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide.
What is the SMILES notation for N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide?
The canonical SMILES for N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide is COc1ccccc1Cc1cnc(NC(=O)C(C)c2ccccc2)o1.
What is the InChIKey of N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide?
The InChIKey is RNPKWGTVSIJOPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-14(15-8-4-3-5-9-15)19(23)22-20-21-13-17(25-20)12-16-10-6-7-11-18(16)24-2/h3-11,13-14H,12H2,1-2H3,(H,21,22,23).
What are the key properties of N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide?
N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide has a molecular weight of 336.39 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]-2-phenylpropanamide is sourced from PubChem (CID 58033132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).