N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide

C15H18N2O2 — CID 3076184

IUPACN-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide
SMILESCCN(C(=O)c1cc(C)on1)c1c(C)cccc1C
InChIInChI=1S/C15H18N2O2/c1-5-17(14-10(2)7-6-8-11(14)3)15(18)13-9-12(4)19-16-13/h6-9H,5H2,1-4H3
InChIKeyNJELPFBGMRMZQT-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.27
Rot. Bonds3

About N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide

N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 3076184) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID3076184
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide
SMILESCCN(C(=O)c1cc(C)on1)c1c(C)cccc1C
InChIInChI=1S/C15H18N2O2/c1-5-17(14-10(2)7-6-8-11(14)3)15(18)13-9-12(4)19-16-13/h6-9H,5H2,1-4H3
InChIKeyNJELPFBGMRMZQT-UHFFFAOYSA-N
XLogP3.27
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide (CID 3076184) is N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide is CCN(C(=O)c1cc(C)on1)c1c(C)cccc1C.
What is the InChIKey of N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is NJELPFBGMRMZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-5-17(14-10(2)7-6-8-11(14)3)15(18)13-9-12(4)19-16-13/h6-9H,5H2,1-4H3.
What are the key properties of N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide?
N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 3076184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).