1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine

C7H9N5 — CID 63078361

IUPAC1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine
SMILESCn1nc(-c2ccn[nH]2)cc1N
InChIInChI=1S/C7H9N5/c1-12-7(8)4-6(11-12)5-2-3-9-10-5/h2-4H,8H2,1H3,(H,9,10)
InChIKeyDJSPQGIWSTZMJB-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.39
Rot. Bonds1

About 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine

1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine (PubChem CID 63078361) has the molecular formula C7H9N5 and a molecular weight of 163.18 g/mol. Its IUPAC name is 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine
PubChem CID63078361
Molecular FormulaC7H9N5
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine
SMILESCn1nc(-c2ccn[nH]2)cc1N
InChIInChI=1S/C7H9N5/c1-12-7(8)4-6(11-12)5-2-3-9-10-5/h2-4H,8H2,1H3,(H,9,10)
InChIKeyDJSPQGIWSTZMJB-UHFFFAOYSA-N
XLogP0.39
TPSA72.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine?
The IUPAC name of 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine (CID 63078361) is 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine is Cn1nc(-c2ccn[nH]2)cc1N.
What is the InChIKey of 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine?
The InChIKey is DJSPQGIWSTZMJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5/c1-12-7(8)4-6(11-12)5-2-3-9-10-5/h2-4H,8H2,1H3,(H,9,10).
What are the key properties of 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine?
1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine has a molecular weight of 163.18 g/mol, XLogP of 0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(1H-pyrazol-5-yl)pyrazol-5-amine is sourced from PubChem (CID 63078361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).