N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide

C13H14N2O2 — CID 110865014

IUPACN-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide
SMILESCCN(C(=O)c1cnco1)c1cccc(C)c1
InChIInChI=1S/C13H14N2O2/c1-3-15(11-6-4-5-10(2)7-11)13(16)12-8-14-9-17-12/h4-9H,3H2,1-2H3
InChIKeyNTQBWIRJDLQFGF-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.65
Rot. Bonds3

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

N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide (PubChem CID 110865014) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide
PubChem CID110865014
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC NameN-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide
SMILESCCN(C(=O)c1cnco1)c1cccc(C)c1
InChIInChI=1S/C13H14N2O2/c1-3-15(11-6-4-5-10(2)7-11)13(16)12-8-14-9-17-12/h4-9H,3H2,1-2H3
InChIKeyNTQBWIRJDLQFGF-UHFFFAOYSA-N
XLogP2.65
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-phenyl-1,3-oxazole-5-carboxamide
CID 110857869
N,4-diethyl-N-(3-methylphenyl)benzamide
CID 533234
N-ethyl-6-methyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 110865026
N-ethyl-N,2-bis(3-methylphenyl)acetamide
CID 113099036
N-ethyl-N-(3-methylphenyl)-4-sulfanylbenzamide
CID 107023760
1-N,1-N,4-N-triethyl-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109048470
N-ethyl-N-(3-methylphenyl)carbamoyl chloride
CID 79001605
6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
CID 62239482
N-ethyl-N-(3-methylphenyl)-5-(morpholine-4-carbonyl)pyridine-3-carboxamide
CID 109103874
N-ethyl-N-(3-methylphenyl)-1H-pyrazole-5-carboxamide
CID 110865006
N-ethyl-3-hydroxy-N-(3-methylphenyl)pyridine-2-carboxamide
CID 61104536
N-ethyl-4-methyl-N-(3-methylphenyl)-1,3-thiazole-2-carboxamide
CID 110696261

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide (CID 110865014) is N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide is CCN(C(=O)c1cnco1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide?
The InChIKey is NTQBWIRJDLQFGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-3-15(11-6-4-5-10(2)7-11)13(16)12-8-14-9-17-12/h4-9H,3H2,1-2H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide?
N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide has a molecular weight of 230.27 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 110865014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).