N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide

C22H25N3O4 — CID 26396186

IUPACN-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide
SMILESCO[C@H](c1ccccc1)c1nnc(CCC(=O)N(CCO)Cc2ccccc2)o1
InChIInChI=1S/C22H25N3O4/c1-28-21(18-10-6-3-7-11-18)22-24-23-19(29-22)12-13-20(27)25(14-15-26)16-17-8-4-2-5-9-17/h2-11,21,26H,12-16H2,1H3/t21-/m1/s1
InChIKeyMGNTWIHJCFFSMS-OAQYLSRUSA-N
MW395.46 g/mol
LogP2.76
Rot. Bonds10

About N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide

N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide (PubChem CID 26396186) has the molecular formula C22H25N3O4 and a molecular weight of 395.46 g/mol. Its IUPAC name is N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide.

Molecular Properties

Compound NameN-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide
PubChem CID26396186
Molecular FormulaC22H25N3O4
Molecular Weight395.46 g/mol
Exact Mass395.18
IUPAC NameN-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide
SMILESCO[C@H](c1ccccc1)c1nnc(CCC(=O)N(CCO)Cc2ccccc2)o1
InChIInChI=1S/C22H25N3O4/c1-28-21(18-10-6-3-7-11-18)22-24-23-19(29-22)12-13-20(27)25(14-15-26)16-17-8-4-2-5-9-17/h2-11,21,26H,12-16H2,1H3/t21-/m1/s1
InChIKeyMGNTWIHJCFFSMS-OAQYLSRUSA-N
XLogP2.76
TPSA88.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide 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-benzyl-N-(2-hydroxyethyl)-3-[5-[methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide
CID 45247454
3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(thiophen-3-ylmethyl)propanamide
CID 25306442
N-(3-cyclopentylpropyl)-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]-N-methylpropanamide
CID 25292482
N-[(4-methoxyphenyl)methyl]-3-[5-[(S)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide
CID 25298167
N-[(4-methoxyphenyl)methyl]-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide
CID 25298169
N-benzyl-N-ethyl-3-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide
CID 110334734
N-benzyl-N-(2-hydroxyethyl)-3-phenylbutanamide
CID 110878165
N-benzyl-4-ethoxy-N-(2-hydroxyethyl)butanamide
CID 112729241
N-benzyl-N-butyl-3-[5-(2,5-dimethylfuran-3-yl)-1,3,4-oxadiazol-2-yl]propanamide
CID 26404535
N-benzyl-5-hydroxy-N-(2-hydroxyethyl)pentanamide
CID 79191990
N-benzyl-N-(2-methoxyethyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 94562085
6-[benzyl(2-hydroxyethyl)amino]-6-oxohexanoic acid
CID 60948107

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide?
The IUPAC name of N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide (CID 26396186) is N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide.
What is the SMILES notation for N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide?
The canonical SMILES for N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide is CO[C@H](c1ccccc1)c1nnc(CCC(=O)N(CCO)Cc2ccccc2)o1.
What is the InChIKey of N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide?
The InChIKey is MGNTWIHJCFFSMS-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H25N3O4/c1-28-21(18-10-6-3-7-11-18)22-24-23-19(29-22)12-13-20(27)25(14-15-26)16-17-8-4-2-5-9-17/h2-11,21,26H,12-16H2,1H3/t21-/m1/s1.
What are the key properties of N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide?
N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide has a molecular weight of 395.46 g/mol, XLogP of 2.76, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-hydroxyethyl)-3-[5-[(R)-methoxy(phenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide is sourced from PubChem (CID 26396186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).