2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide

C15H20N4O3 — CID 86909866

IUPAC2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide
SMILESCOc1cccc(-c2noc(CN(CC(N)=O)C(C)C)n2)c1
InChIInChI=1S/C15H20N4O3/c1-10(2)19(8-13(16)20)9-14-17-15(18-22-14)11-5-4-6-12(7-11)21-3/h4-7,10H,8-9H2,1-3H3,(H2,16,20)
InChIKeyGMFKDZSPKMTKMW-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.44
Rot. Bonds7

About 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide

2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide (PubChem CID 86909866) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide.

Molecular Properties

Compound Name2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide
PubChem CID86909866
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide
SMILESCOc1cccc(-c2noc(CN(CC(N)=O)C(C)C)n2)c1
InChIInChI=1S/C15H20N4O3/c1-10(2)19(8-13(16)20)9-14-17-15(18-22-14)11-5-4-6-12(7-11)21-3/h4-7,10H,8-9H2,1-3H3,(H2,16,20)
InChIKeyGMFKDZSPKMTKMW-UHFFFAOYSA-N
XLogP1.44
TPSA94.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylmethanesulfonamide
CID 53278196
N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3,5-dimethoxy-N-propan-2-ylbenzamide
CID 6494708
2-(3-methoxyphenoxy)-N-methyl-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]propanamide
CID 132657248
3-(3-methoxyphenyl)-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-propan-2-ylurea
CID 8895627
3-(3-methoxyphenyl)-5-propyl-1,2,4-oxadiazole
CID 143434606
3-chloro-N-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylbenzamide
CID 50874619
3-(2,6-dichlorophenyl)-N-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpropanamide
CID 100604591
2,4-dimethoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-propan-2-ylbenzamide
CID 2991778
N-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methyl-2-thiophen-2-ylacetamide
CID 100634154
(2S)-2-(2-chlorophenoxy)-N-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methylpropanamide
CID 97267417
2-[[2-(3-methoxyphenyl)-2-oxoethyl]-propan-2-ylamino]acetamide
CID 60680137
3,4-dimethoxy-N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-propan-2-ylbenzamide
CID 3164333

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide?
The IUPAC name of 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide (CID 86909866) is 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide.
What is the SMILES notation for 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide?
The canonical SMILES for 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide is COc1cccc(-c2noc(CN(CC(N)=O)C(C)C)n2)c1.
What is the InChIKey of 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide?
The InChIKey is GMFKDZSPKMTKMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-10(2)19(8-13(16)20)9-14-17-15(18-22-14)11-5-4-6-12(7-11)21-3/h4-7,10H,8-9H2,1-3H3,(H2,16,20).
What are the key properties of 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide?
2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide has a molecular weight of 304.35 g/mol, XLogP of 1.44, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-propan-2-ylamino]acetamide is sourced from PubChem (CID 86909866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).