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

C14H16N2O2 — CID 5307726

IUPACN-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2cccc(C)c2C)o1
InChIInChI=1S/C14H16N2O2/c1-8-6-5-7-12(9(8)2)16-14(17)13-10(3)15-11(4)18-13/h5-7H,1-4H3,(H,16,17)
InChIKeyUJAUANMAQHJFKP-UHFFFAOYSA-N
MW244.29 g/mol
LogP3.16
Rot. Bonds2

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

N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide (PubChem CID 5307726) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
PubChem CID5307726
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2cccc(C)c2C)o1
InChIInChI=1S/C14H16N2O2/c1-8-6-5-7-12(9(8)2)16-14(17)13-10(3)15-11(4)18-13/h5-7H,1-4H3,(H,16,17)
InChIKeyUJAUANMAQHJFKP-UHFFFAOYSA-N
XLogP3.16
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 7113442
N-(2,3-dimethylphenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
CID 110684721
N-(2-chlorophenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 4140143
N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide
CID 30464286
2,4-dimethyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazole-5-carboxamide
CID 110684897
N-(5-chloro-2-methylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 7113446
3-[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]naphthalene-2-carboxylic acid
CID 99644527
N-(2,3-dimethylphenyl)-3-methylbenzo[g][1]benzofuran-2-carboxamide
CID 7946958
N-(3-bromophenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 7113434
3-[(2,3-dimethylphenyl)carbamoyl]-1,2-oxazole-5-carboxylic acid
CID 107369167
N-(2-bromo-5-iodophenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 113249343
N-(5-bromo-2-iodophenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 113247217

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide (CID 5307726) is N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide is Cc1nc(C)c(C(=O)Nc2cccc(C)c2C)o1.
What is the InChIKey of N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
The InChIKey is UJAUANMAQHJFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-8-6-5-7-12(9(8)2)16-14(17)13-10(3)15-11(4)18-13/h5-7H,1-4H3,(H,16,17).
What are the key properties of N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide?
N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 5307726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).