N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide

C22H23N3O3 — CID 42769030

IUPACN-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide
SMILESCCCN(CC(=O)Nc1ccon1)C(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H23N3O3/c1-2-14-25(16-20(26)23-19-13-15-28-24-19)22(27)21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-13,15,21H,2,14,16H2,1H3,(H,23,24,26)
InChIKeyQFTVTLWPWGQIPY-UHFFFAOYSA-N
MW377.44 g/mol
LogP3.68
Rot. Bonds8

About N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide

N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide (PubChem CID 42769030) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide.

Molecular Properties

Compound NameN-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide
PubChem CID42769030
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide
SMILESCCCN(CC(=O)Nc1ccon1)C(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H23N3O3/c1-2-14-25(16-20(26)23-19-13-15-28-24-19)22(27)21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-13,15,21H,2,14,16H2,1H3,(H,23,24,26)
InChIKeyQFTVTLWPWGQIPY-UHFFFAOYSA-N
XLogP3.68
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2-phenylbutanamide
CID 42769157
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2-phenyl-N-prop-2-enylbutanamide
CID 3332397
2-[[2,6-di(propan-2-yl)phenyl]carbamoyl-propylamino]-N-(1,2-oxazol-3-yl)acetamide
CID 42769288
3-(1,2-oxazol-3-yl)-1,1-dipropylurea
CID 108811952
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propyltetradecanamide
CID 42664167
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propylcyclopentanecarboxamide
CID 42769032
3-chloro-2,2-dimethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propylpropanamide
CID 4114305
3-fluoro-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-propylbenzamide
CID 813670
2-[(2-ethoxyphenyl)carbamoyl-propylamino]-N-(1,2-oxazol-3-yl)acetamide
CID 813823
N-ethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2-phenylacetamide
CID 814456
N-ethyl-2-methyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide
CID 814467
N-(3-methylbutyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide
CID 4087470

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide?
The IUPAC name of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide (CID 42769030) is N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide.
What is the SMILES notation for N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide?
The canonical SMILES for N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide is CCCN(CC(=O)Nc1ccon1)C(=O)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide?
The InChIKey is QFTVTLWPWGQIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-2-14-25(16-20(26)23-19-13-15-28-24-19)22(27)21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-13,15,21H,2,14,16H2,1H3,(H,23,24,26).
What are the key properties of N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide?
N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide has a molecular weight of 377.44 g/mol, XLogP of 3.68, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-2,2-diphenyl-N-propylacetamide is sourced from PubChem (CID 42769030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).