1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole

C8H10N4 — CID 7147386

IUPAC1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole
SMILESCc1nn(C)cc1-c1ccn[nH]1
InChIInChI=1S/C8H10N4/c1-6-7(5-12(2)11-6)8-3-4-9-10-8/h3-5H,1-2H3,(H,9,10)
InChIKeyLNJKDWJFZASOPC-UHFFFAOYSA-N
MW162.20 g/mol
LogP1.12
Rot. Bonds1

About 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole

1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole (PubChem CID 7147386) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole.

Molecular Properties

Compound Name1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole
PubChem CID7147386
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole
SMILESCc1nn(C)cc1-c1ccn[nH]1
InChIInChI=1S/C8H10N4/c1-6-7(5-12(2)11-6)8-3-4-9-10-8/h3-5H,1-2H3,(H,9,10)
InChIKeyLNJKDWJFZASOPC-UHFFFAOYSA-N
XLogP1.12
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole?
The IUPAC name of 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole (CID 7147386) is 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole.
What is the SMILES notation for 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole?
The canonical SMILES for 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole is Cc1nn(C)cc1-c1ccn[nH]1.
What is the InChIKey of 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole?
The InChIKey is LNJKDWJFZASOPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-6-7(5-12(2)11-6)8-3-4-9-10-8/h3-5H,1-2H3,(H,9,10).
What are the key properties of 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole?
1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole has a molecular weight of 162.20 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-(1H-pyrazol-5-yl)pyrazole is sourced from PubChem (CID 7147386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).