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

C13H14N2O2 — CID 30464286

IUPACN-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2cccc(C)c2C)co1
InChIInChI=1S/C13H14N2O2/c1-8-5-4-6-11(9(8)2)15-13(16)12-7-17-10(3)14-12/h4-7H,1-3H3,(H,15,16)
InChIKeyIVKUZPAWJNUQBM-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.85
Rot. Bonds2

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

N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide (PubChem CID 30464286) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide
PubChem CID30464286
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC NameN-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2cccc(C)c2C)co1
InChIInChI=1S/C13H14N2O2/c1-8-5-4-6-11(9(8)2)15-13(16)12-7-17-10(3)14-12/h4-7H,1-3H3,(H,15,16)
InChIKeyIVKUZPAWJNUQBM-UHFFFAOYSA-N
XLogP2.85
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dichlorophenyl)-2-methyl-1,3-oxazole-4-carboxamide
CID 30402707
N-(2,3-dimethylphenyl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 5307726
2-methyl-N-(2-phenoxyphenyl)-1,3-oxazole-4-carboxamide
CID 30402981
N-(2,3-dimethylphenyl)-2-methyl-4-propan-2-yl-1,3-oxazole-5-carboxamide
CID 110684721
N-(2,3-dimethylphenyl)-5-methylpyrazine-2-carboxamide
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3-[(2,3-dimethylphenyl)carbamoyl]-1,2-oxazole-5-carboxylic acid
CID 107369167
N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 694797
N-(4-bromo-2,6-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide
CID 100801901
5-(1-chloroethyl)-N-(2,3-dimethylphenyl)furan-2-carboxamide
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N-(3,5-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide
CID 30464297
N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-methyl-1,3-oxazole-4-carboxamide
CID 100775650
N-(2,3-dimethylphenyl)-6-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109096051

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide (CID 30464286) is N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide is Cc1nc(C(=O)Nc2cccc(C)c2C)co1.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
The InChIKey is IVKUZPAWJNUQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-8-5-4-6-11(9(8)2)15-13(16)12-7-17-10(3)14-12/h4-7H,1-3H3,(H,15,16).
What are the key properties of N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide?
N-(2,3-dimethylphenyl)-2-methyl-1,3-oxazole-4-carboxamide has a molecular weight of 230.27 g/mol, XLogP of 2.85, 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-methyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 30464286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).