3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide

C15H17N5O2 — CID 56749318

IUPAC3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
SMILESCc1noc(CN(C)C(=O)CCn2cnc3ccccc32)n1
InChIInChI=1S/C15H17N5O2/c1-11-17-14(22-18-11)9-19(2)15(21)7-8-20-10-16-12-5-3-4-6-13(12)20/h3-6,10H,7-9H2,1-2H3
InChIKeyYFOPZWURODPVMX-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.78
Rot. Bonds5

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

3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide (PubChem CID 56749318) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
PubChem CID56749318
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC Name3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
SMILESCc1noc(CN(C)C(=O)CCn2cnc3ccccc32)n1
InChIInChI=1S/C15H17N5O2/c1-11-17-14(22-18-11)9-19(2)15(21)7-8-20-10-16-12-5-3-4-6-13(12)20/h3-6,10H,7-9H2,1-2H3
InChIKeyYFOPZWURODPVMX-UHFFFAOYSA-N
XLogP1.78
TPSA77.05 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
The IUPAC name of 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide (CID 56749318) is 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide.
What is the SMILES notation for 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
The canonical SMILES for 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide is Cc1noc(CN(C)C(=O)CCn2cnc3ccccc32)n1.
What is the InChIKey of 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
The InChIKey is YFOPZWURODPVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c1-11-17-14(22-18-11)9-19(2)15(21)7-8-20-10-16-12-5-3-4-6-13(12)20/h3-6,10H,7-9H2,1-2H3.
What are the key properties of 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide has a molecular weight of 299.33 g/mol, XLogP of 1.78, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzimidazol-1-yl)-N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide is sourced from PubChem (CID 56749318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).