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

C21H25N5O2 — CID 155956554

IUPAC3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide
SMILESCc1cc(-n2cccn2)ccc1CNC(=O)CCc1nnc(C2CCCC2)o1
InChIInChI=1S/C21H25N5O2/c1-15-13-18(26-12-4-11-23-26)8-7-17(15)14-22-19(27)9-10-20-24-25-21(28-20)16-5-2-3-6-16/h4,7-8,11-13,16H,2-3,5-6,9-10,14H2,1H3,(H,22,27)
InChIKeyUVBGLUDQEGMYBJ-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.47
Rot. Bonds7

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

3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide (PubChem CID 155956554) has the molecular formula C21H25N5O2 and a molecular weight of 379.46 g/mol. Its IUPAC name is 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide
PubChem CID155956554
Molecular FormulaC21H25N5O2
Molecular Weight379.46 g/mol
Exact Mass379.20
IUPAC Name3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide
SMILESCc1cc(-n2cccn2)ccc1CNC(=O)CCc1nnc(C2CCCC2)o1
InChIInChI=1S/C21H25N5O2/c1-15-13-18(26-12-4-11-23-26)8-7-17(15)14-22-19(27)9-10-20-24-25-21(28-20)16-5-2-3-6-16/h4,7-8,11-13,16H,2-3,5-6,9-10,14H2,1H3,(H,22,27)
InChIKeyUVBGLUDQEGMYBJ-UHFFFAOYSA-N
XLogP3.47
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide 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 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
The IUPAC name of 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide (CID 155956554) is 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide.
What is the SMILES notation for 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
The canonical SMILES for 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide is Cc1cc(-n2cccn2)ccc1CNC(=O)CCc1nnc(C2CCCC2)o1.
What is the InChIKey of 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
The InChIKey is UVBGLUDQEGMYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O2/c1-15-13-18(26-12-4-11-23-26)8-7-17(15)14-22-19(27)9-10-20-24-25-21(28-20)16-5-2-3-6-16/h4,7-8,11-13,16H,2-3,5-6,9-10,14H2,1H3,(H,22,27).
What are the key properties of 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide?
3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide has a molecular weight of 379.46 g/mol, XLogP of 3.47, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(2-methyl-4-pyrazol-1-ylphenyl)methyl]propanamide is sourced from PubChem (CID 155956554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).