N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide

C13H13N3O2 — CID 110693154

IUPACN-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
SMILESCc1nnc(-c2ccc(C(=O)NC3CC3)cc2)o1
InChIInChI=1S/C13H13N3O2/c1-8-15-16-13(18-8)10-4-2-9(3-5-10)12(17)14-11-6-7-11/h2-5,11H,6-7H2,1H3,(H,14,17)
InChIKeyQGEHSBVENHRGMC-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.94
Rot. Bonds3

About N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide

N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide (PubChem CID 110693154) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
PubChem CID110693154
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC NameN-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
SMILESCc1nnc(-c2ccc(C(=O)NC3CC3)cc2)o1
InChIInChI=1S/C13H13N3O2/c1-8-15-16-13(18-8)10-4-2-9(3-5-10)12(17)14-11-6-7-11/h2-5,11H,6-7H2,1H3,(H,14,17)
InChIKeyQGEHSBVENHRGMC-UHFFFAOYSA-N
XLogP1.94
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 21078792
cis-(1S,3R)-3-[[4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]benzoyl]amino]cyclopentane-1-carboxylic acid
CID 120675801
N-[(2-hydroxycyclopentyl)methyl]-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 111540657
N-cycloheptyl-4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 26002230
N-(2,5-dimethylphenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 110693237
N-(cyclopropylmethyl)-4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 21078798
N-[4-(cyclopentylcarbamoyl)phenyl]-4-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 55820403
N-cyclopropyl-5-(4-methoxyphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 110392032
4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-[1-(2-phenylethyl)piperidin-4-yl]benzamide
CID 112822743
N-(1-cyclopropylethyl)-4-[2-methyl-5-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 21078781
3,4-dimethyl-N-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 110725536
4-[5-(5-methyl-3-phenyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]-N-(oxan-4-yl)benzamide
CID 16723002

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide?
The IUPAC name of N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide (CID 110693154) is N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide.
What is the SMILES notation for N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide?
The canonical SMILES for N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide is Cc1nnc(-c2ccc(C(=O)NC3CC3)cc2)o1.
What is the InChIKey of N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide?
The InChIKey is QGEHSBVENHRGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-8-15-16-13(18-8)10-4-2-9(3-5-10)12(17)14-11-6-7-11/h2-5,11H,6-7H2,1H3,(H,14,17).
What are the key properties of N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide?
N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide has a molecular weight of 243.27 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide is sourced from PubChem (CID 110693154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).