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

C14H16N2O2S — CID 15998429

IUPACN-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(-c2cccs2)on1
InChIInChI=1S/C14H16N2O2S/c17-14(15-10-5-2-1-3-6-10)11-9-12(18-16-11)13-7-4-8-19-13/h4,7-10H,1-3,5-6H2,(H,15,17)
InChIKeyFWDRXAVMCPEUSP-UHFFFAOYSA-N
MW276.36 g/mol
LogP3.47
Rot. Bonds3

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

N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 15998429) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
PubChem CID15998429
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(-c2cccs2)on1
InChIInChI=1S/C14H16N2O2S/c17-14(15-10-5-2-1-3-6-10)11-9-12(18-16-11)13-7-4-8-19-13/h4,7-10H,1-3,5-6H2,(H,15,17)
InChIKeyFWDRXAVMCPEUSP-UHFFFAOYSA-N
XLogP3.47
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide (CID 15998429) is N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide is O=C(NC1CCCCC1)c1cc(-c2cccs2)on1.
What is the InChIKey of N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is FWDRXAVMCPEUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c17-14(15-10-5-2-1-3-6-10)11-9-12(18-16-11)13-7-4-8-19-13/h4,7-10H,1-3,5-6H2,(H,15,17).
What are the key properties of N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide?
N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 15998429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).