N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide

C17H15N3O2 — CID 110390946

IUPACN-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide
SMILESCCN(C(=O)c1nnc(-c2ccccc2)o1)c1ccccc1
InChIInChI=1S/C17H15N3O2/c1-2-20(14-11-7-4-8-12-14)17(21)16-19-18-15(22-16)13-9-5-3-6-10-13/h3-12H,2H2,1H3
InChIKeyXKSUOJUVCLMSCP-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.40
Rot. Bonds4

About N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide

N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide (PubChem CID 110390946) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide
PubChem CID110390946
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide
SMILESCCN(C(=O)c1nnc(-c2ccccc2)o1)c1ccccc1
InChIInChI=1S/C17H15N3O2/c1-2-20(14-11-7-4-8-12-14)17(21)16-19-18-15(22-16)13-9-5-3-6-10-13/h3-12H,2H2,1H3
InChIKeyXKSUOJUVCLMSCP-UHFFFAOYSA-N
XLogP3.40
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-5-(4-fluorophenyl)-N-phenyl-1,3,4-oxadiazole-2-carboxamide
CID 110392696
N-ethyl-5-(3-methoxyphenyl)-N-phenyl-1,3,4-oxadiazole-2-carboxamide
CID 110391942
N-ethyl-5-(3-fluorophenyl)-N-(3-methylphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 110392587
N-ethyl-5-(3-methoxyphenyl)-N-(3-methylphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 110392025
1-(5-phenyl-1,3,4-oxadiazol-2-yl)pentan-1-one
CID 148946555
(2S)-N-ethyl-N-phenyl-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide
CID 2673980
N,N-diethyl-5-(4-methylphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 110391105
2-phenyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethanone
CID 2461697
N-[1-oxo-1-(5-phenyl-1,3,4-oxadiazol-2-yl)hexan-2-yl]formamide
CID 23586812
N-benzyl-5-phenyl-1,3,4-oxadiazole-2-carboxamide
CID 22431714
N-ethyl-5-nitro-N-phenylfuran-2-carboxamide
CID 773502
5-(2-chlorophenyl)-N,N-diethyl-1,3,4-oxadiazole-2-carboxamide
CID 110391269

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide?
The IUPAC name of N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide (CID 110390946) is N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide.
What is the SMILES notation for N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide?
The canonical SMILES for N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide is CCN(C(=O)c1nnc(-c2ccccc2)o1)c1ccccc1.
What is the InChIKey of N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide?
The InChIKey is XKSUOJUVCLMSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-2-20(14-11-7-4-8-12-14)17(21)16-19-18-15(22-16)13-9-5-3-6-10-13/h3-12H,2H2,1H3.
What are the key properties of N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide?
N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 3.40, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,5-diphenyl-1,3,4-oxadiazole-2-carboxamide is sourced from PubChem (CID 110390946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).