4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine

C9H11N5O — CID 29044722

IUPAC4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine
SMILESCn1ncc(-c2nc(C3CC3)no2)c1N
InChIInChI=1S/C9H11N5O/c1-14-7(10)6(4-11-14)9-12-8(13-15-9)5-2-3-5/h4-5H,2-3,10H2,1H3
InChIKeyUOOKPCHLWPOOPO-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.93
Rot. Bonds2

About 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine

4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine (PubChem CID 29044722) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine
PubChem CID29044722
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC Name4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine
SMILESCn1ncc(-c2nc(C3CC3)no2)c1N
InChIInChI=1S/C9H11N5O/c1-14-7(10)6(4-11-14)9-12-8(13-15-9)5-2-3-5/h4-5H,2-3,10H2,1H3
InChIKeyUOOKPCHLWPOOPO-UHFFFAOYSA-N
XLogP0.93
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine (CID 29044722) is 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine is Cn1ncc(-c2nc(C3CC3)no2)c1N.
What is the InChIKey of 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine?
The InChIKey is UOOKPCHLWPOOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c1-14-7(10)6(4-11-14)9-12-8(13-15-9)5-2-3-5/h4-5H,2-3,10H2,1H3.
What are the key properties of 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine?
4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine has a molecular weight of 205.22 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 29044722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).