N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide

C13H12N2O2S — CID 74335612

IUPACN-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CC1)c1cc(C=Cc2cccs2)on1
InChIInChI=1S/C13H12N2O2S/c16-13(14-9-3-4-9)12-8-10(17-15-12)5-6-11-2-1-7-18-11/h1-2,5-9H,3-4H2,(H,14,16)
InChIKeyUHMZBEJIKOGJRN-UHFFFAOYSA-N
MW260.32 g/mol
LogP2.80
Rot. Bonds4

About N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide

N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide (PubChem CID 74335612) has the molecular formula C13H12N2O2S and a molecular weight of 260.32 g/mol. Its IUPAC name is N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide
PubChem CID74335612
Molecular FormulaC13H12N2O2S
Molecular Weight260.32 g/mol
Exact Mass260.06
IUPAC NameN-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CC1)c1cc(C=Cc2cccs2)on1
InChIInChI=1S/C13H12N2O2S/c16-13(14-9-3-4-9)12-8-10(17-15-12)5-6-11-2-1-7-18-11/h1-2,5-9H,3-4H2,(H,14,16)
InChIKeyUHMZBEJIKOGJRN-UHFFFAOYSA-N
XLogP2.80
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 3242425
N-cyclobutyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 24794414
N-cycloheptyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 4777467
N-[4-(4,6-dimethylpyrimidin-2-yl)oxycyclohexyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 90634916
[4-[(5-ethenyl-1,2-oxazole-3-carbonyl)amino]cyclohexyl]azanium
CID 163919078
5-propan-2-yl-N-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-1,2-oxazole-3-carboxamide
CID 102602829
(E)-N-cyclopentyl-3-thiophen-2-ylprop-2-enamide
CID 2164351
N-[4-[dimethylamino(thiophen-2-yl)methyl]cyclohexyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 140543006
N-cyclopropyl-5-thiophen-3-yl-1,2-oxazole-3-carboxamide
CID 24859444
N-cyclopropyl-1-methyl-5-thiophen-2-ylpyrazole-3-carboxamide
CID 110335992
N-[(5S)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-5-yl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 124760825
N-[(1S,2S)-2-hydroxycyclohexyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 104957384

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide (CID 74335612) is N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide is O=C(NC1CC1)c1cc(C=Cc2cccs2)on1.
What is the InChIKey of N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is UHMZBEJIKOGJRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2S/c16-13(14-9-3-4-9)12-8-10(17-15-12)5-6-11-2-1-7-18-11/h1-2,5-9H,3-4H2,(H,14,16).
What are the key properties of N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide?
N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 260.32 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 74335612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).