N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide

C10H10N2O2S — CID 45106990

IUPACN-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
SMILESCCNC(=O)c1ncoc1-c1cccs1
InChIInChI=1S/C10H10N2O2S/c1-2-11-10(13)8-9(14-6-12-8)7-4-3-5-15-7/h3-6H,2H2,1H3,(H,11,13)
InChIKeyUGQJTXQCCRVYBN-UHFFFAOYSA-N
MW222.27 g/mol
LogP2.15
Rot. Bonds3

About N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide

N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide (PubChem CID 45106990) has the molecular formula C10H10N2O2S and a molecular weight of 222.27 g/mol. Its IUPAC name is N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
PubChem CID45106990
Molecular FormulaC10H10N2O2S
Molecular Weight222.27 g/mol
Exact Mass222.05
IUPAC NameN-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide
SMILESCCNC(=O)c1ncoc1-c1cccs1
InChIInChI=1S/C10H10N2O2S/c1-2-11-10(13)8-9(14-6-12-8)7-4-3-5-15-7/h3-6H,2H2,1H3,(H,11,13)
InChIKeyUGQJTXQCCRVYBN-UHFFFAOYSA-N
XLogP2.15
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide (CID 45106990) is N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide is CCNC(=O)c1ncoc1-c1cccs1.
What is the InChIKey of N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
The InChIKey is UGQJTXQCCRVYBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2S/c1-2-11-10(13)8-9(14-6-12-8)7-4-3-5-15-7/h3-6H,2H2,1H3,(H,11,13).
What are the key properties of N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide?
N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide has a molecular weight of 222.27 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-thiophen-2-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 45106990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).