5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide

C16H17ClN2O2 — CID 17252724

IUPAC5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(-c2ccc(Cl)cc2)on1
InChIInChI=1S/C16H17ClN2O2/c17-12-8-6-11(7-9-12)15-10-14(19-21-15)16(20)18-13-4-2-1-3-5-13/h6-10,13H,1-5H2,(H,18,20)
InChIKeyOAXQVBQSICONLJ-UHFFFAOYSA-N
MW304.78 g/mol
LogP4.06
Rot. Bonds3

About 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide

5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide (PubChem CID 17252724) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide
PubChem CID17252724
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC Name5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(-c2ccc(Cl)cc2)on1
InChIInChI=1S/C16H17ClN2O2/c17-12-8-6-11(7-9-12)15-10-14(19-21-15)16(20)18-13-4-2-1-3-5-13/h6-10,13H,1-5H2,(H,18,20)
InChIKeyOAXQVBQSICONLJ-UHFFFAOYSA-N
XLogP4.06
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-chlorophenyl)-N-(2,3-dihydro-1H-inden-2-yl)-1,2-oxazole-3-carboxamide
CID 57383583
N-cycloheptyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 4777467
N-cyclopentyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 3242425
N-cyclobutyl-5-(3-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 144981703
1-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]-3-cyclohexylurea
CID 112503079
5-(4-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 119513121
N-cyclopropyl-5-thiophen-3-yl-1,2-oxazole-3-carboxamide
CID 24859444
N-cyclobutyl-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 24794414
5-(4-chlorophenyl)-1,2-oxazole-3-carboxylic acid
CID 1133644
N-(2-amino-1-cyclopropylethyl)-5-(4-chlorophenyl)-1,2-oxazole-3-carboxamide
CID 119616138
5-(4-chlorophenyl)-N-cycloheptyl-1,3,4-oxadiazole-2-carboxamide
CID 110391563
5-(4-chlorophenyl)-N-cyclopentyl-4-cyclopropyl-1,2-oxazole-3-carboxamide
CID 67121170

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide (CID 17252724) is 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide is O=C(NC1CCCCC1)c1cc(-c2ccc(Cl)cc2)on1.
What is the InChIKey of 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide?
The InChIKey is OAXQVBQSICONLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c17-12-8-6-11(7-9-12)15-10-14(19-21-15)16(20)18-13-4-2-1-3-5-13/h6-10,13H,1-5H2,(H,18,20).
What are the key properties of 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide?
5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-cyclohexyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 17252724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).