3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide

C18H17N3O3 — CID 110333704

IUPAC3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide
SMILESCc1nnc(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)o1
InChIInChI=1S/C18H17N3O3/c1-13-20-21-18(23-13)12-11-17(22)19-14-7-9-16(10-8-14)24-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,19,22)
InChIKeyGNUGFNYJWGKCHB-UHFFFAOYSA-N
MW323.35 g/mol
LogP3.74
Rot. Bonds6

About 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide

3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide (PubChem CID 110333704) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide
PubChem CID110333704
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC Name3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide
SMILESCc1nnc(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)o1
InChIInChI=1S/C18H17N3O3/c1-13-20-21-18(23-13)12-11-17(22)19-14-7-9-16(10-8-14)24-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,19,22)
InChIKeyGNUGFNYJWGKCHB-UHFFFAOYSA-N
XLogP3.74
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 ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-cyanophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
CID 110333736
N-(3-bromo-4-methylphenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
CID 110333672
N-[4-(2-chlorophenoxy)phenyl]-3-(5-phenyl-1,3,4-oxadiazol-2-yl)propanamide
CID 35894204
N-(2,6-dichlorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanamide
CID 110333728
3-phenoxy-N-(4-phenoxyphenyl)propanamide
CID 108795457
3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-phenoxyphenyl)propanamide
CID 100759603
N-(4-phenoxyphenyl)-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide
CID 55834700
N-(4-propan-2-yloxyphenyl)-3-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)propanamide
CID 110330322
N-(4-acetamidophenyl)-3-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide
CID 110334977
5-[(5-methyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]-N-(4-phenoxyphenyl)-1,3,4-thiadiazol-2-amine
CID 9220434
5-chloro-N-(4-phenoxyphenyl)pentanamide
CID 28971507
N-(4-methoxyphenyl)-3-(4-phenoxyanilino)propanamide
CID 109039635

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide?
The IUPAC name of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide (CID 110333704) is 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide.
What is the SMILES notation for 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide?
The canonical SMILES for 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide is Cc1nnc(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)o1.
What is the InChIKey of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide?
The InChIKey is GNUGFNYJWGKCHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-13-20-21-18(23-13)12-11-17(22)19-14-7-9-16(10-8-14)24-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,19,22).
What are the key properties of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide?
3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide has a molecular weight of 323.35 g/mol, XLogP of 3.74, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-phenoxyphenyl)propanamide is sourced from PubChem (CID 110333704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).