5-pyrimidin-5-yl-1H-pyrazol-4-amine

C7H7N5 — CID 96634021

IUPAC5-pyrimidin-5-yl-1H-pyrazol-4-amine
SMILESNc1cn[nH]c1-c1cncnc1
InChIInChI=1S/C7H7N5/c8-6-3-11-12-7(6)5-1-9-4-10-2-5/h1-4H,8H2,(H,11,12)
InChIKeyRRAQWAPNZLWLFN-UHFFFAOYSA-N
MW161.17 g/mol
LogP0.45
Rot. Bonds1

About 5-pyrimidin-5-yl-1H-pyrazol-4-amine

5-pyrimidin-5-yl-1H-pyrazol-4-amine (PubChem CID 96634021) has the molecular formula C7H7N5 and a molecular weight of 161.17 g/mol. Its IUPAC name is 5-pyrimidin-5-yl-1H-pyrazol-4-amine.

Molecular Properties

Compound Name5-pyrimidin-5-yl-1H-pyrazol-4-amine
PubChem CID96634021
Molecular FormulaC7H7N5
Molecular Weight161.17 g/mol
Exact Mass161.07
IUPAC Name5-pyrimidin-5-yl-1H-pyrazol-4-amine
SMILESNc1cn[nH]c1-c1cncnc1
InChIInChI=1S/C7H7N5/c8-6-3-11-12-7(6)5-1-9-4-10-2-5/h1-4H,8H2,(H,11,12)
InChIKeyRRAQWAPNZLWLFN-UHFFFAOYSA-N
XLogP0.45
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.17
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-pyrimidin-5-yl-1H-pyrazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-pyrimidin-5-yl-1H-pyrazol-4-amine?
The IUPAC name of 5-pyrimidin-5-yl-1H-pyrazol-4-amine (CID 96634021) is 5-pyrimidin-5-yl-1H-pyrazol-4-amine.
What is the SMILES notation for 5-pyrimidin-5-yl-1H-pyrazol-4-amine?
The canonical SMILES for 5-pyrimidin-5-yl-1H-pyrazol-4-amine is Nc1cn[nH]c1-c1cncnc1.
What is the InChIKey of 5-pyrimidin-5-yl-1H-pyrazol-4-amine?
The InChIKey is RRAQWAPNZLWLFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N5/c8-6-3-11-12-7(6)5-1-9-4-10-2-5/h1-4H,8H2,(H,11,12).
What are the key properties of 5-pyrimidin-5-yl-1H-pyrazol-4-amine?
5-pyrimidin-5-yl-1H-pyrazol-4-amine has a molecular weight of 161.17 g/mol, XLogP of 0.45, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrimidin-5-yl-1H-pyrazol-4-amine is sourced from PubChem (CID 96634021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).