N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide

C22H24N2O3 — CID 143053456

IUPACN-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccc(Oc3cc(C(C)(C)C)on3)cc2)cc1
InChIInChI=1S/C22H24N2O3/c1-5-15-6-8-16(9-7-15)21(25)23-17-10-12-18(13-11-17)26-20-14-19(27-24-20)22(2,3)4/h6-14H,5H2,1-4H3,(H,23,25)
InChIKeyGBMIXLLFIZHVLX-UHFFFAOYSA-N
MW364.45 g/mol
LogP5.58
Rot. Bonds5

About N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide

N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide (PubChem CID 143053456) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide.

Molecular Properties

Compound NameN-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide
PubChem CID143053456
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccc(Oc3cc(C(C)(C)C)on3)cc2)cc1
InChIInChI=1S/C22H24N2O3/c1-5-15-6-8-16(9-7-15)21(25)23-17-10-12-18(13-11-17)26-20-14-19(27-24-20)22(2,3)4/h6-14H,5H2,1-4H3,(H,23,25)
InChIKeyGBMIXLLFIZHVLX-UHFFFAOYSA-N
XLogP5.58
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.45
LogP ≤ 55.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-chlorobenzamide
CID 143053139
N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)carbamoylamino]phenyl]-4-ethylbenzamide
CID 11441130
4-[2-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-(4-methylphenyl)benzamide
CID 59420454
1-(4-acetylphenyl)-N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]piperidine-4-carboxamide
CID 143052936
4-ethyl-N-[4-(2,2,2-trifluoroethoxy)phenyl]benzamide
CID 134010354
1-(5-tert-butyl-1,2-oxazol-3-yl)-3-(4-ethylphenyl)thiourea
CID 19687440
4-[(5-tert-butyl-1,2-oxazol-3-yl)carbamoylamino]-N-phenylbenzamide
CID 46883422
4-[(5-tert-butyl-1,2-oxazol-3-yl)carbamoylamino]-N-pyridin-4-ylbenzamide
CID 46883461
3-bromo-N-[4-[2-[(5-tert-butyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]phenyl]benzamide
CID 59420609
4-tert-butyl-N-[4-(3-fluorophenoxy)phenyl]benzamide
CID 142594929
4-ethyl-N-[4-[6-(3,4,5-trimethylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]benzamide
CID 122305793
ethane;4-ethyl-N-(4-methylphenyl)benzamide
CID 143234775

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide?
The IUPAC name of N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide (CID 143053456) is N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide.
What is the SMILES notation for N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide?
The canonical SMILES for N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide is CCc1ccc(C(=O)Nc2ccc(Oc3cc(C(C)(C)C)on3)cc2)cc1.
What is the InChIKey of N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide?
The InChIKey is GBMIXLLFIZHVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-5-15-6-8-16(9-7-15)21(25)23-17-10-12-18(13-11-17)26-20-14-19(27-24-20)22(2,3)4/h6-14H,5H2,1-4H3,(H,23,25).
What are the key properties of N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide?
N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide has a molecular weight of 364.45 g/mol, XLogP of 5.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-tert-butyl-1,2-oxazol-3-yl)oxy]phenyl]-4-ethylbenzamide is sourced from PubChem (CID 143053456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).