N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide

C22H22N2O4 — CID 126766426

IUPACN-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide
SMILESO=C(COCC1CCOC1)Nc1nc(-c2ccccc2)c(-c2ccccc2)o1
InChIInChI=1S/C22H22N2O4/c25-19(15-27-14-16-11-12-26-13-16)23-22-24-20(17-7-3-1-4-8-17)21(28-22)18-9-5-2-6-10-18/h1-10,16H,11-15H2,(H,23,24,25)
InChIKeyNSWDNFAAIOIVFM-UHFFFAOYSA-N
MW378.43 g/mol
LogP4.00
Rot. Bonds7

About N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide

N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide (PubChem CID 126766426) has the molecular formula C22H22N2O4 and a molecular weight of 378.43 g/mol. Its IUPAC name is N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide.

Molecular Properties

Compound NameN-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide
PubChem CID126766426
Molecular FormulaC22H22N2O4
Molecular Weight378.43 g/mol
Exact Mass378.16
IUPAC NameN-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide
SMILESO=C(COCC1CCOC1)Nc1nc(-c2ccccc2)c(-c2ccccc2)o1
InChIInChI=1S/C22H22N2O4/c25-19(15-27-14-16-11-12-26-13-16)23-22-24-20(17-7-3-1-4-8-17)21(28-22)18-9-5-2-6-10-18/h1-10,16H,11-15H2,(H,23,24,25)
InChIKeyNSWDNFAAIOIVFM-UHFFFAOYSA-N
XLogP4.00
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide?
The IUPAC name of N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide (CID 126766426) is N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide.
What is the SMILES notation for N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide?
The canonical SMILES for N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide is O=C(COCC1CCOC1)Nc1nc(-c2ccccc2)c(-c2ccccc2)o1.
What is the InChIKey of N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide?
The InChIKey is NSWDNFAAIOIVFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4/c25-19(15-27-14-16-11-12-26-13-16)23-22-24-20(17-7-3-1-4-8-17)21(28-22)18-9-5-2-6-10-18/h1-10,16H,11-15H2,(H,23,24,25).
What are the key properties of N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide?
N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide has a molecular weight of 378.43 g/mol, XLogP of 4.00, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-diphenyl-1,3-oxazol-2-yl)-2-(oxolan-3-ylmethoxy)acetamide is sourced from PubChem (CID 126766426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).