2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide

C22H19N3O2S — CID 24675874

IUPAC2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide
SMILESCc1oc(-c2ccccc2)nc1CC(=O)NCc1csc(-c2ccccc2)n1
InChIInChI=1S/C22H19N3O2S/c1-15-19(25-21(27-15)16-8-4-2-5-9-16)12-20(26)23-13-18-14-28-22(24-18)17-10-6-3-7-11-17/h2-11,14H,12-13H2,1H3,(H,23,26)
InChIKeyKPSRKDOQAOWDCB-UHFFFAOYSA-N
MW389.48 g/mol
LogP4.63
Rot. Bonds6

About 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide

2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide (PubChem CID 24675874) has the molecular formula C22H19N3O2S and a molecular weight of 389.48 g/mol. Its IUPAC name is 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide
PubChem CID24675874
Molecular FormulaC22H19N3O2S
Molecular Weight389.48 g/mol
Exact Mass389.12
IUPAC Name2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide
SMILESCc1oc(-c2ccccc2)nc1CC(=O)NCc1csc(-c2ccccc2)n1
InChIInChI=1S/C22H19N3O2S/c1-15-19(25-21(27-15)16-8-4-2-5-9-16)12-20(26)23-13-18-14-28-22(24-18)17-10-6-3-7-11-17/h2-11,14H,12-13H2,1H3,(H,23,26)
InChIKeyKPSRKDOQAOWDCB-UHFFFAOYSA-N
XLogP4.63
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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N-(3-aminobutyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
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N-[(2-hydroxycyclopentyl)methyl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 111464140
benzyl 2-[[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetyl]amino]acetate
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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide?
The IUPAC name of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide (CID 24675874) is 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide is Cc1oc(-c2ccccc2)nc1CC(=O)NCc1csc(-c2ccccc2)n1.
What is the InChIKey of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide?
The InChIKey is KPSRKDOQAOWDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2S/c1-15-19(25-21(27-15)16-8-4-2-5-9-16)12-20(26)23-13-18-14-28-22(24-18)17-10-6-3-7-11-17/h2-11,14H,12-13H2,1H3,(H,23,26).
What are the key properties of 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide?
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide has a molecular weight of 389.48 g/mol, XLogP of 4.63, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]acetamide is sourced from PubChem (CID 24675874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).