N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide

C11H10N2O2S — CID 19582717

IUPACN-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CC1)c1cc(-c2cccs2)on1
InChIInChI=1S/C11H10N2O2S/c14-11(12-7-3-4-7)8-6-9(15-13-8)10-2-1-5-16-10/h1-2,5-7H,3-4H2,(H,12,14)
InChIKeySYENTKHGMVKGAQ-UHFFFAOYSA-N
MW234.28 g/mol
LogP2.30
Rot. Bonds3

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

N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 19582717) has the molecular formula C11H10N2O2S and a molecular weight of 234.28 g/mol. Its IUPAC name is N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
PubChem CID19582717
Molecular FormulaC11H10N2O2S
Molecular Weight234.28 g/mol
Exact Mass234.05
IUPAC NameN-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CC1)c1cc(-c2cccs2)on1
InChIInChI=1S/C11H10N2O2S/c14-11(12-7-3-4-7)8-6-9(15-13-8)10-2-1-5-16-10/h1-2,5-7H,3-4H2,(H,12,14)
InChIKeySYENTKHGMVKGAQ-UHFFFAOYSA-N
XLogP2.30
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide (CID 19582717) is N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide is O=C(NC1CC1)c1cc(-c2cccs2)on1.
What is the InChIKey of N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is SYENTKHGMVKGAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2S/c14-11(12-7-3-4-7)8-6-9(15-13-8)10-2-1-5-16-10/h1-2,5-7H,3-4H2,(H,12,14).
What are the key properties of N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 234.28 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 19582717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).