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

C26H24N2O3 — CID 46392793

IUPACN-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccc(C)c(-c2coc(-c3ccc(NC(=O)COc4ccccc4C)cc3)n2)c1
InChIInChI=1S/C26H24N2O3/c1-17-8-9-18(2)22(14-17)23-15-31-26(28-23)20-10-12-21(13-11-20)27-25(29)16-30-24-7-5-4-6-19(24)3/h4-15H,16H2,1-3H3,(H,27,29)
InChIKeyLVWXGKRZPZJUKP-UHFFFAOYSA-N
MW412.49 g/mol
LogP5.95
Rot. Bonds6

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

N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide (PubChem CID 46392793) has the molecular formula C26H24N2O3 and a molecular weight of 412.49 g/mol. Its IUPAC name is N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide
PubChem CID46392793
Molecular FormulaC26H24N2O3
Molecular Weight412.49 g/mol
Exact Mass412.18
IUPAC NameN-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccc(C)c(-c2coc(-c3ccc(NC(=O)COc4ccccc4C)cc3)n2)c1
InChIInChI=1S/C26H24N2O3/c1-17-8-9-18(2)22(14-17)23-15-31-26(28-23)20-10-12-21(13-11-20)27-25(29)16-30-24-7-5-4-6-19(24)3/h4-15H,16H2,1-3H3,(H,27,29)
InChIKeyLVWXGKRZPZJUKP-UHFFFAOYSA-N
XLogP5.95
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.49
LogP ≤ 55.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-(2-methylphenoxy)acetamide
CID 1361277
N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2,2-dimethylpropanamide
CID 46392788
1-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea
CID 46392912
2-(2,5-dimethylphenoxy)-N-[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide
CID 4062395
2-(2-methylphenoxy)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 108748059
2-(2-chlorophenoxy)-N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide
CID 17131987
N-[4-(5-bromo-4-methyl-1,3-benzoxazol-2-yl)phenyl]-2-(2-methylphenoxy)acetamide
CID 46226016
1-[4-[4-(2,4-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-3-(4-methylphenyl)urea
CID 50835614
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetohydrazide
CID 35819755
2-(2-methylphenoxy)-N-[4-(5-methyl-1H-pyrazol-3-yl)phenyl]acetamide
CID 110732601
N-[2-methyl-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-2-(2-methylphenoxy)acetamide;hydrate
CID 21211864
2-(2-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 747103

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide (CID 46392793) is N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide is Cc1ccc(C)c(-c2coc(-c3ccc(NC(=O)COc4ccccc4C)cc3)n2)c1.
What is the InChIKey of N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide?
The InChIKey is LVWXGKRZPZJUKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O3/c1-17-8-9-18(2)22(14-17)23-15-31-26(28-23)20-10-12-21(13-11-20)27-25(29)16-30-24-7-5-4-6-19(24)3/h4-15H,16H2,1-3H3,(H,27,29).
What are the key properties of N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide?
N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide has a molecular weight of 412.49 g/mol, XLogP of 5.95, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(2,5-dimethylphenyl)-1,3-oxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 46392793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).