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

C11H14N6O2 — CID 106391751

IUPAC4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESNc1c(C(=O)NCCc2ncon2)n[nH]c1C1CC1
InChIInChI=1S/C11H14N6O2/c12-8-9(6-1-2-6)15-16-10(8)11(18)13-4-3-7-14-5-19-17-7/h5-6H,1-4,12H2,(H,13,18)(H,15,16)
InChIKeyICJOAYYJIFYOID-UHFFFAOYSA-N
MW262.27 g/mol
LogP0.22
Rot. Bonds5

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

4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide (PubChem CID 106391751) has the molecular formula C11H14N6O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide
PubChem CID106391751
Molecular FormulaC11H14N6O2
Molecular Weight262.27 g/mol
Exact Mass262.12
IUPAC Name4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESNc1c(C(=O)NCCc2ncon2)n[nH]c1C1CC1
InChIInChI=1S/C11H14N6O2/c12-8-9(6-1-2-6)15-16-10(8)11(18)13-4-3-7-14-5-19-17-7/h5-6H,1-4,12H2,(H,13,18)(H,15,16)
InChIKeyICJOAYYJIFYOID-UHFFFAOYSA-N
XLogP0.22
TPSA122.72 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide (CID 106391751) is 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide is Nc1c(C(=O)NCCc2ncon2)n[nH]c1C1CC1.
What is the InChIKey of 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
The InChIKey is ICJOAYYJIFYOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O2/c12-8-9(6-1-2-6)15-16-10(8)11(18)13-4-3-7-14-5-19-17-7/h5-6H,1-4,12H2,(H,13,18)(H,15,16).
What are the key properties of 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide has a molecular weight of 262.27 g/mol, XLogP of 0.22, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 106391751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).