N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide

C15H17N3O2 — CID 22431707

IUPACN-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide
SMILESO=C(NC1CCCCC1)c1nnc(-c2ccccc2)o1
InChIInChI=1S/C15H17N3O2/c19-13(16-12-9-5-2-6-10-12)15-18-17-14(20-15)11-7-3-1-4-8-11/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,16,19)
InChIKeyLJOCPBBGQLZOFH-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.80
Rot. Bonds3

About N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide

N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide (PubChem CID 22431707) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide
PubChem CID22431707
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide
SMILESO=C(NC1CCCCC1)c1nnc(-c2ccccc2)o1
InChIInChI=1S/C15H17N3O2/c19-13(16-12-9-5-2-6-10-12)15-18-17-14(20-15)11-7-3-1-4-8-11/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,16,19)
InChIKeyLJOCPBBGQLZOFH-UHFFFAOYSA-N
XLogP2.80
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide
CID 22431706
N-cyclopropyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide
CID 22431746
5-(4-chlorophenyl)-N-cycloheptyl-1,3,4-oxadiazole-2-carboxamide
CID 110391563
N-cyclohexyl-5-[4-(dimethylsulfamoyl)phenyl]-1,3,4-oxadiazole-2-carboxamide
CID 53011956
N-cycloheptyl-5-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 46393391
N-cyclopropyl-5-(4-methoxyphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 110392032
cyclopentyl 5-phenyl-1,3,4-oxadiazole-2-carboxylate
CID 132551637
N-cyclohexyl-2,4-diphenyl-1,3-oxazole-5-carboxamide
CID 15090685
N-cycloheptyl-4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 26002230
N-cyclopentyl-3-[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]propanamide
CID 42346090
5-[(2-chlorophenyl)methyl]-N-cyclooctyl-1,3,4-oxadiazole-2-carboxamide
CID 22431938
N-cyclohexyl-6-phenylpyridazine-3-carboxamide
CID 113200519

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide?
The IUPAC name of N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide (CID 22431707) is N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide?
The canonical SMILES for N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide is O=C(NC1CCCCC1)c1nnc(-c2ccccc2)o1.
What is the InChIKey of N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide?
The InChIKey is LJOCPBBGQLZOFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-13(16-12-9-5-2-6-10-12)15-18-17-14(20-15)11-7-3-1-4-8-11/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,16,19).
What are the key properties of N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide?
N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 22431707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).