2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide

C18H23N5O2 — CID 72877351

IUPAC2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide
SMILESCCc1nc2ccccc2n1C(CC)C(=O)N(C)Cc1noc(C)n1
InChIInChI=1S/C18H23N5O2/c1-5-14(18(24)22(4)11-16-19-12(3)25-21-16)23-15-10-8-7-9-13(15)20-17(23)6-2/h7-10,14H,5-6,11H2,1-4H3
InChIKeySVRZPUGRDWVJNT-UHFFFAOYSA-N
MW341.42 g/mol
LogP2.90
Rot. Bonds6

About 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide

2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide (PubChem CID 72877351) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide
PubChem CID72877351
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide
SMILESCCc1nc2ccccc2n1C(CC)C(=O)N(C)Cc1noc(C)n1
InChIInChI=1S/C18H23N5O2/c1-5-14(18(24)22(4)11-16-19-12(3)25-21-16)23-15-10-8-7-9-13(15)20-17(23)6-2/h7-10,14H,5-6,11H2,1-4H3
InChIKeySVRZPUGRDWVJNT-UHFFFAOYSA-N
XLogP2.90
TPSA77.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide (CID 72877351) is 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide is CCc1nc2ccccc2n1C(CC)C(=O)N(C)Cc1noc(C)n1.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide?
The InChIKey is SVRZPUGRDWVJNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-5-14(18(24)22(4)11-16-19-12(3)25-21-16)23-15-10-8-7-9-13(15)20-17(23)6-2/h7-10,14H,5-6,11H2,1-4H3.
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide?
2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide has a molecular weight of 341.42 g/mol, XLogP of 2.90, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbenzimidazol-1-yl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butanamide is sourced from PubChem (CID 72877351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).