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

C15H21N5O2 — CID 91644648

IUPAC3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide
SMILESCc1[nH]ncc1CNC(=O)CCc1nc(C2CCCC2)no1
InChIInChI=1S/C15H21N5O2/c1-10-12(9-17-19-10)8-16-13(21)6-7-14-18-15(20-22-14)11-4-2-3-5-11/h9,11H,2-8H2,1H3,(H,16,21)(H,17,19)
InChIKeyQJEPRPUELUPHBC-UHFFFAOYSA-N
MW303.37 g/mol
LogP2.01
Rot. Bonds6

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

3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide (PubChem CID 91644648) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide
PubChem CID91644648
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide
SMILESCc1[nH]ncc1CNC(=O)CCc1nc(C2CCCC2)no1
InChIInChI=1S/C15H21N5O2/c1-10-12(9-17-19-10)8-16-13(21)6-7-14-18-15(20-22-14)11-4-2-3-5-11/h9,11H,2-8H2,1H3,(H,16,21)(H,17,19)
InChIKeyQJEPRPUELUPHBC-UHFFFAOYSA-N
XLogP2.01
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide?
The IUPAC name of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide (CID 91644648) is 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide.
What is the SMILES notation for 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide?
The canonical SMILES for 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide is Cc1[nH]ncc1CNC(=O)CCc1nc(C2CCCC2)no1.
What is the InChIKey of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide?
The InChIKey is QJEPRPUELUPHBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-10-12(9-17-19-10)8-16-13(21)6-7-14-18-15(20-22-14)11-4-2-3-5-11/h9,11H,2-8H2,1H3,(H,16,21)(H,17,19).
What are the key properties of 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide?
3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide has a molecular weight of 303.37 g/mol, XLogP of 2.01, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide is sourced from PubChem (CID 91644648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).