4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride

C3H7ClN6 — CID 3057065

IUPAC4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride
SMILESCl.NNc1ncnc(N)n1
InChIInChI=1S/C3H6N6.ClH/c4-2-6-1-7-3(8-2)9-5;/h1H,5H2,(H3,4,6,7,8,9);1H
InChIKeyYPUNMSKLHTXWHY-UHFFFAOYSA-N
MW162.58 g/mol
LogP-0.84
Rot. Bonds1

About 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride

4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride (PubChem CID 3057065) has the molecular formula C3H7ClN6 and a molecular weight of 162.58 g/mol. Its IUPAC name is 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride.

Molecular Properties

Compound Name4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride
PubChem CID3057065
Molecular FormulaC3H7ClN6
Molecular Weight162.58 g/mol
Exact Mass162.04
IUPAC Name4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride
SMILESCl.NNc1ncnc(N)n1
InChIInChI=1S/C3H6N6.ClH/c4-2-6-1-7-3(8-2)9-5;/h1H,5H2,(H3,4,6,7,8,9);1H
InChIKeyYPUNMSKLHTXWHY-UHFFFAOYSA-N
XLogP-0.84
TPSA102.74 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.58
LogP ≤ 5-0.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride?
The IUPAC name of 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride (CID 3057065) is 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride.
What is the SMILES notation for 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride?
The canonical SMILES for 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride is Cl.NNc1ncnc(N)n1.
What is the InChIKey of 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride?
The InChIKey is YPUNMSKLHTXWHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.ClH/c4-2-6-1-7-3(8-2)9-5;/h1H,5H2,(H3,4,6,7,8,9);1H.
What are the key properties of 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride?
4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride has a molecular weight of 162.58 g/mol, XLogP of -0.84, 1 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-1,3,5-triazin-2-amine;hydrochloride is sourced from PubChem (CID 3057065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).