N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide

C20H21N3O2 — CID 95906928

IUPACN-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide
SMILESCc1nnc(-c2cccc(C(=O)N(C)C[C@H](C)c3ccccc3)c2)o1
InChIInChI=1S/C20H21N3O2/c1-14(16-8-5-4-6-9-16)13-23(3)20(24)18-11-7-10-17(12-18)19-22-21-15(2)25-19/h4-12,14H,13H2,1-3H3/t14-/m0/s1
InChIKeyQDVDLESJHYVLEB-AWEZNQCLSA-N
MW335.41 g/mol
LogP3.92
Rot. Bonds5

About N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide

N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide (PubChem CID 95906928) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide.

Molecular Properties

Compound NameN-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide
PubChem CID95906928
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide
SMILESCc1nnc(-c2cccc(C(=O)N(C)C[C@H](C)c3ccccc3)c2)o1
InChIInChI=1S/C20H21N3O2/c1-14(16-8-5-4-6-9-16)13-23(3)20(24)18-11-7-10-17(12-18)19-22-21-15(2)25-19/h4-12,14H,13H2,1-3H3/t14-/m0/s1
InChIKeyQDVDLESJHYVLEB-AWEZNQCLSA-N
XLogP3.92
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-2-hydroxy-2-phenylethyl]-N-methyl-3-(1-propan-2-ylimidazol-2-yl)benzamide
CID 125165527
[(1R)-2-ethoxy-2-oxo-1-phenylethyl] 3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzoate
CID 27276566
N-[2-(3,4-dichlorophenyl)propyl]-N-methylbenzamide
CID 22405750
5-[methyl-[(2S)-2-phenylpropyl]carbamoyl]furan-2-carboxylic acid
CID 99851700
2-[3-[3-[(1R)-1-methoxyethyl]phenyl]phenyl]-5-methyl-1,3,4-oxadiazole
CID 97437656
[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-pyrrolidin-1-ylmethanone
CID 155948637
4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]benzamide
CID 97074910
(2-cyano-3-phenylpropyl) 3-(5-methyl-1,3,4-oxadiazol-2-yl)benzoate
CID 71969414
N-methyl-5-(1-methylpyrazol-4-yl)-N-[(2R)-2-phenylpropyl]pyridine-3-carboxamide
CID 95617225
3-(6-aminopyrazin-2-yl)-N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 162634482
N-ethyl-N-methyl-4-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 134063386
N-(2,6-difluorophenyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 99817536

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide?
The IUPAC name of N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide (CID 95906928) is N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide.
What is the SMILES notation for N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide?
The canonical SMILES for N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide is Cc1nnc(-c2cccc(C(=O)N(C)C[C@H](C)c3ccccc3)c2)o1.
What is the InChIKey of N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide?
The InChIKey is QDVDLESJHYVLEB-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-14(16-8-5-4-6-9-16)13-23(3)20(24)18-11-7-10-17(12-18)19-22-21-15(2)25-19/h4-12,14H,13H2,1-3H3/t14-/m0/s1.
What are the key properties of N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide?
N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide has a molecular weight of 335.41 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-N-[(2R)-2-phenylpropyl]benzamide is sourced from PubChem (CID 95906928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).