2-(1H-pyrazol-5-yl)-1,3,5-triazine

C6H5N5 — CID 66676329

IUPAC2-(1H-pyrazol-5-yl)-1,3,5-triazine
SMILESc1cc(-c2ncncn2)[nH]n1
InChIInChI=1S/C6H5N5/c1-2-10-11-5(1)6-8-3-7-4-9-6/h1-4H,(H,10,11)
InChIKeyDWGKRFLDSZNFJH-UHFFFAOYSA-N
MW147.14 g/mol
LogP0.26
Rot. Bonds1

About 2-(1H-pyrazol-5-yl)-1,3,5-triazine

2-(1H-pyrazol-5-yl)-1,3,5-triazine (PubChem CID 66676329) has the molecular formula C6H5N5 and a molecular weight of 147.14 g/mol. Its IUPAC name is 2-(1H-pyrazol-5-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(1H-pyrazol-5-yl)-1,3,5-triazine
PubChem CID66676329
Molecular FormulaC6H5N5
Molecular Weight147.14 g/mol
Exact Mass147.05
IUPAC Name2-(1H-pyrazol-5-yl)-1,3,5-triazine
SMILESc1cc(-c2ncncn2)[nH]n1
InChIInChI=1S/C6H5N5/c1-2-10-11-5(1)6-8-3-7-4-9-6/h1-4H,(H,10,11)
InChIKeyDWGKRFLDSZNFJH-UHFFFAOYSA-N
XLogP0.26
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.14
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(1H-pyrazol-5-yl)-1,3,5-triazine 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 2-(1H-pyrazol-5-yl)-1,3,5-triazine?
The IUPAC name of 2-(1H-pyrazol-5-yl)-1,3,5-triazine (CID 66676329) is 2-(1H-pyrazol-5-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(1H-pyrazol-5-yl)-1,3,5-triazine?
The canonical SMILES for 2-(1H-pyrazol-5-yl)-1,3,5-triazine is c1cc(-c2ncncn2)[nH]n1.
What is the InChIKey of 2-(1H-pyrazol-5-yl)-1,3,5-triazine?
The InChIKey is DWGKRFLDSZNFJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5/c1-2-10-11-5(1)6-8-3-7-4-9-6/h1-4H,(H,10,11).
What are the key properties of 2-(1H-pyrazol-5-yl)-1,3,5-triazine?
2-(1H-pyrazol-5-yl)-1,3,5-triazine has a molecular weight of 147.14 g/mol, XLogP of 0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrazol-5-yl)-1,3,5-triazine is sourced from PubChem (CID 66676329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).