5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide

C11H14N6O2 — CID 102703332

IUPAC5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)Nc1nnc(C2CCCN2)o1
InChIInChI=1S/C11H14N6O2/c1-6-7(5-13-15-6)9(18)14-11-17-16-10(19-11)8-3-2-4-12-8/h5,8,12H,2-4H2,1H3,(H,13,15)(H,14,17,18)
InChIKeyOSRARHCKTSLSHC-UHFFFAOYSA-N
MW262.27 g/mol
LogP0.78
Rot. Bonds3

About 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide

5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide (PubChem CID 102703332) has the molecular formula C11H14N6O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide
PubChem CID102703332
Molecular FormulaC11H14N6O2
Molecular Weight262.27 g/mol
Exact Mass262.12
IUPAC Name5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide
SMILESCc1[nH]ncc1C(=O)Nc1nnc(C2CCCN2)o1
InChIInChI=1S/C11H14N6O2/c1-6-7(5-13-15-6)9(18)14-11-17-16-10(19-11)8-3-2-4-12-8/h5,8,12H,2-4H2,1H3,(H,13,15)(H,14,17,18)
InChIKeyOSRARHCKTSLSHC-UHFFFAOYSA-N
XLogP0.78
TPSA108.73 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide (CID 102703332) is 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide is Cc1[nH]ncc1C(=O)Nc1nnc(C2CCCN2)o1.
What is the InChIKey of 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide?
The InChIKey is OSRARHCKTSLSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O2/c1-6-7(5-13-15-6)9(18)14-11-17-16-10(19-11)8-3-2-4-12-8/h5,8,12H,2-4H2,1H3,(H,13,15)(H,14,17,18).
What are the key properties of 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide?
5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide has a molecular weight of 262.27 g/mol, XLogP of 0.78, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 102703332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).