N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide

C13H15N3O3 — CID 104553459

IUPACN-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide
SMILESCC(CO)N(C)C(=O)c1ccc(-c2nnco2)cc1
InChIInChI=1S/C13H15N3O3/c1-9(7-17)16(2)13(18)11-5-3-10(4-6-11)12-15-14-8-19-12/h3-6,8-9,17H,7H2,1-2H3
InChIKeyOPJILSWBJIXBPU-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.19
Rot. Bonds4

About N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide

N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide (PubChem CID 104553459) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide
PubChem CID104553459
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC NameN-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide
SMILESCC(CO)N(C)C(=O)c1ccc(-c2nnco2)cc1
InChIInChI=1S/C13H15N3O3/c1-9(7-17)16(2)13(18)11-5-3-10(4-6-11)12-15-14-8-19-12/h3-6,8-9,17H,7H2,1-2H3
InChIKeyOPJILSWBJIXBPU-UHFFFAOYSA-N
XLogP1.19
TPSA79.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide 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

4-(dimethylamino)-N-(1-hydroxypropan-2-yl)-N-methylbenzamide
CID 113344177
N-(1-hydroxypropan-2-yl)-4-iodo-N-methylbenzamide
CID 115765134
4-chloro-N-(1-hydroxypropan-2-yl)-N-methylbenzamide
CID 115765131
[(2R)-1-(dimethylamino)-1-oxopropan-2-yl] 4-(1,3,4-oxadiazol-2-yl)benzoate
CID 8925511
4-(1,3,4-oxadiazol-2-yl)benzamide
CID 43236825
[(2S)-1-oxo-1-(propylamino)propan-2-yl] 4-(1,3,4-oxadiazol-2-yl)benzoate
CID 8999397
4-(bromomethyl)-N-(1-hydroxypropan-2-yl)-N-methylbenzamide
CID 102852055
3-[[4-(1,3,4-oxadiazol-2-yl)benzoyl]amino]propanoic acid
CID 43354760
2-[4-(1,3,4-oxadiazol-2-yl)anilino]propanoic acid
CID 66172483
[(2R)-1-[di(propan-2-yl)amino]-1-oxopropan-2-yl] 4-(1,3,4-oxadiazol-2-yl)benzoate
CID 8999438
4-butyl-N-(1-hydroxypropan-2-yl)-N-methylbenzamide
CID 113343131
N-(5-hydroxypentyl)-4-(1,3,4-oxadiazol-2-yl)benzamide
CID 107318774

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide (CID 104553459) is N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide is CC(CO)N(C)C(=O)c1ccc(-c2nnco2)cc1.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide?
The InChIKey is OPJILSWBJIXBPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-9(7-17)16(2)13(18)11-5-3-10(4-6-11)12-15-14-8-19-12/h3-6,8-9,17H,7H2,1-2H3.
What are the key properties of N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide?
N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide has a molecular weight of 261.28 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-N-methyl-4-(1,3,4-oxadiazol-2-yl)benzamide is sourced from PubChem (CID 104553459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).