N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide

C18H17N3O3 — CID 110725650

IUPACN-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide
SMILESCc1nnc(-c2cccc(NC(=O)CCOc3ccccc3)c2)o1
InChIInChI=1S/C18H17N3O3/c1-13-20-21-18(24-13)14-6-5-7-15(12-14)19-17(22)10-11-23-16-8-3-2-4-9-16/h2-9,12H,10-11H2,1H3,(H,19,22)
InChIKeyUFONRPUCACSSPM-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.45
Rot. Bonds6

About N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide

N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide (PubChem CID 110725650) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide.

Molecular Properties

Compound NameN-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide
PubChem CID110725650
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide
SMILESCc1nnc(-c2cccc(NC(=O)CCOc3ccccc3)c2)o1
InChIInChI=1S/C18H17N3O3/c1-13-20-21-18(24-13)14-6-5-7-15(12-14)19-17(22)10-11-23-16-8-3-2-4-9-16/h2-9,12H,10-11H2,1H3,(H,19,22)
InChIKeyUFONRPUCACSSPM-UHFFFAOYSA-N
XLogP3.45
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methoxyphenyl)-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 110725688
N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-2-(3-methylphenyl)acetamide
CID 110725681
N-(2-methyl-1,3-benzoxazol-6-yl)-3-phenoxypropanamide
CID 110729007
2-(4-fluorophenoxy)-N-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 17359046
3-phenyl-N-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]propanamide
CID 1315264
3,5-dimethoxy-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 110725637
N-[5-(3,5-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-phenoxypropanamide
CID 4075839
2-methyl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pent-2-enamide
CID 71999088
3-phenoxy-N-(5-phenyl-3-pyridinyl)propanamide
CID 110713724
4-[3,5-bis(5-methyl-1,3,4-oxadiazol-2-yl)anilino]-4-oxobutanoic acid
CID 156686282
2-hydroxy-4-(3-phenoxypropanoylamino)benzoic acid
CID 108806972
N-(3-formylphenyl)-3-phenoxypropanamide
CID 106912466

Frequently Asked Questions

What is the IUPAC name of N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide?
The IUPAC name of N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide (CID 110725650) is N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide.
What is the SMILES notation for N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide?
The canonical SMILES for N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide is Cc1nnc(-c2cccc(NC(=O)CCOc3ccccc3)c2)o1.
What is the InChIKey of N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide?
The InChIKey is UFONRPUCACSSPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-13-20-21-18(24-13)14-6-5-7-15(12-14)19-17(22)10-11-23-16-8-3-2-4-9-16/h2-9,12H,10-11H2,1H3,(H,19,22).
What are the key properties of N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide?
N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide has a molecular weight of 323.35 g/mol, XLogP of 3.45, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-3-phenoxypropanamide is sourced from PubChem (CID 110725650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).