2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole

C9H10N6 — CID 141409395

IUPAC2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole
SMILESC1=CN(c2ccn[nH]2)N(c2ncc[nH]2)C1
InChIInChI=1S/C9H10N6/c1-6-14(8-2-3-12-13-8)15(7-1)9-10-4-5-11-9/h1-6H,7H2,(H,10,11)(H,12,13)
InChIKeyBLGYXRADWGDICI-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.89
Rot. Bonds2

About 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole

2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole (PubChem CID 141409395) has the molecular formula C9H10N6 and a molecular weight of 202.22 g/mol. Its IUPAC name is 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole.

Molecular Properties

Compound Name2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole
PubChem CID141409395
Molecular FormulaC9H10N6
Molecular Weight202.22 g/mol
Exact Mass202.10
IUPAC Name2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole
SMILESC1=CN(c2ccn[nH]2)N(c2ncc[nH]2)C1
InChIInChI=1S/C9H10N6/c1-6-14(8-2-3-12-13-8)15(7-1)9-10-4-5-11-9/h1-6H,7H2,(H,10,11)(H,12,13)
InChIKeyBLGYXRADWGDICI-UHFFFAOYSA-N
XLogP0.89
TPSA63.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole?
The IUPAC name of 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole (CID 141409395) is 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole.
What is the SMILES notation for 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole?
The canonical SMILES for 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole is C1=CN(c2ccn[nH]2)N(c2ncc[nH]2)C1.
What is the InChIKey of 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole?
The InChIKey is BLGYXRADWGDICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6/c1-6-14(8-2-3-12-13-8)15(7-1)9-10-4-5-11-9/h1-6H,7H2,(H,10,11)(H,12,13).
What are the key properties of 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole?
2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole has a molecular weight of 202.22 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1H-pyrazol-5-yl)-3H-pyrazol-2-yl]-1H-imidazole is sourced from PubChem (CID 141409395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).