N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

C18H16N2O2 — CID 17011506

IUPACN-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3cccc(C)c3)no2)cc1
InChIInChI=1S/C18H16N2O2/c1-12-6-8-14(9-7-12)17-11-16(20-22-17)18(21)19-15-5-3-4-13(2)10-15/h3-11H,1-2H3,(H,19,21)
InChIKeyFEWZUEPXCTXKMF-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.21
Rot. Bonds3

About N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide (PubChem CID 17011506) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
PubChem CID17011506
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC NameN-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3cccc(C)c3)no2)cc1
InChIInChI=1S/C18H16N2O2/c1-12-6-8-14(9-7-12)17-11-16(20-22-17)18(21)19-15-5-3-4-13(2)10-15/h3-11H,1-2H3,(H,19,21)
InChIKeyFEWZUEPXCTXKMF-UHFFFAOYSA-N
XLogP4.21
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[4-(diaminomethylideneamino)phenyl]-N-(3-methylphenyl)-1,2-oxazole-3-carboxamide;hydrochloride
CID 90644253
5-(4-methylphenyl)-N-[3-(tetrazol-1-yl)phenyl]-1,2-oxazole-3-carboxamide
CID 146021404
5-(2-methoxyphenyl)-N-(3-methylphenyl)-1,2-oxazole-3-carboxamide
CID 46417466
5-(4-methylphenyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]-1,2-oxazole-3-carboxamide
CID 17022145
5-(4-methoxyphenyl)-N-[2-[(3-methylphenyl)carbamoyl]-1-benzofuran-3-yl]-1,2-oxazole-3-carboxamide
CID 17010949
N-(3-hydroxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093722
N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 27285951
N,5-bis(3,4-dimethylphenyl)-1,2-oxazole-3-carboxamide
CID 17011912
N-(2-chloro-4-methylphenyl)-5-(4-chlorophenyl)-1,2-oxazole-3-carboxamide
CID 112807159
5-(4-methylphenyl)-N-(2-methylsulfanylphenyl)-1,2-oxazole-3-carboxamide
CID 1252354
5-methyl-N-[3-[(5-methyl-1,2-oxazole-3-carbonyl)amino]phenyl]-1,2-oxazole-3-carboxamide
CID 58725196
5-(4-chlorophenyl)-N-(3-nitrophenyl)-1,2-oxazole-3-carboxamide
CID 31776990

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide (CID 17011506) is N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide is Cc1ccc(-c2cc(C(=O)Nc3cccc(C)c3)no2)cc1.
What is the InChIKey of N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is FEWZUEPXCTXKMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-12-6-8-14(9-7-12)17-11-16(20-22-17)18(21)19-15-5-3-4-13(2)10-15/h3-11H,1-2H3,(H,19,21).
What are the key properties of N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 17011506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).