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

C14H16N2O3 — CID 53195131

IUPACN-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide
SMILESCCOc1ccc(NC(=O)c2nc(C)oc2C)cc1
InChIInChI=1S/C14H16N2O3/c1-4-18-12-7-5-11(6-8-12)16-14(17)13-9(2)19-10(3)15-13/h5-8H,4H2,1-3H3,(H,16,17)
InChIKeyUYHCYVCSZMIUCT-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.94
Rot. Bonds4

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

N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide (PubChem CID 53195131) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide
PubChem CID53195131
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC NameN-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide
SMILESCCOc1ccc(NC(=O)c2nc(C)oc2C)cc1
InChIInChI=1S/C14H16N2O3/c1-4-18-12-7-5-11(6-8-12)16-14(17)13-9(2)19-10(3)15-13/h5-8H,4H2,1-3H3,(H,16,17)
InChIKeyUYHCYVCSZMIUCT-UHFFFAOYSA-N
XLogP2.94
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide (CID 53195131) is N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide is CCOc1ccc(NC(=O)c2nc(C)oc2C)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide?
The InChIKey is UYHCYVCSZMIUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-4-18-12-7-5-11(6-8-12)16-14(17)13-9(2)19-10(3)15-13/h5-8H,4H2,1-3H3,(H,16,17).
What are the key properties of N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide?
N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide has a molecular weight of 260.29 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 53195131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).