N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide

C15H19N5O2 — CID 50957352

IUPACN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide
SMILESO=C(NCc1noc(C2CCCC2)n1)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C15H19N5O2/c21-14(12-7-11(18-19-12)9-5-6-9)16-8-13-17-15(22-20-13)10-3-1-2-4-10/h7,9-10H,1-6,8H2,(H,16,21)(H,18,19)
InChIKeySGKCEZVMEHYIFX-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.26
Rot. Bonds5

About N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide

N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide (PubChem CID 50957352) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide
PubChem CID50957352
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC NameN-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide
SMILESO=C(NCc1noc(C2CCCC2)n1)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C15H19N5O2/c21-14(12-7-11(18-19-12)9-5-6-9)16-8-13-17-15(22-20-13)10-3-1-2-4-10/h7,9-10H,1-6,8H2,(H,16,21)(H,18,19)
InChIKeySGKCEZVMEHYIFX-UHFFFAOYSA-N
XLogP2.26
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide (CID 50957352) is N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide is O=C(NCc1noc(C2CCCC2)n1)c1cc(C2CC2)[nH]n1.
What is the InChIKey of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide?
The InChIKey is SGKCEZVMEHYIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c21-14(12-7-11(18-19-12)9-5-6-9)16-8-13-17-15(22-20-13)10-3-1-2-4-10/h7,9-10H,1-6,8H2,(H,16,21)(H,18,19).
What are the key properties of N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide?
N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 50957352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).