1-pentyl-2-(triazin-4-yl)hydrazine

C8H15N5 — CID 67103777

IUPAC1-pentyl-2-(triazin-4-yl)hydrazine
SMILESCCCCCNNc1ccnnn1
InChIInChI=1S/C8H15N5/c1-2-3-4-6-9-11-8-5-7-10-13-12-8/h5,7,9H,2-4,6H2,1H3,(H,10,11,12)
InChIKeyBGRYTBNHIDZKSP-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.98
Rot. Bonds6

About 1-pentyl-2-(triazin-4-yl)hydrazine

1-pentyl-2-(triazin-4-yl)hydrazine (PubChem CID 67103777) has the molecular formula C8H15N5 and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-pentyl-2-(triazin-4-yl)hydrazine.

Molecular Properties

Compound Name1-pentyl-2-(triazin-4-yl)hydrazine
PubChem CID67103777
Molecular FormulaC8H15N5
Molecular Weight181.24 g/mol
Exact Mass181.13
IUPAC Name1-pentyl-2-(triazin-4-yl)hydrazine
SMILESCCCCCNNc1ccnnn1
InChIInChI=1S/C8H15N5/c1-2-3-4-6-9-11-8-5-7-10-13-12-8/h5,7,9H,2-4,6H2,1H3,(H,10,11,12)
InChIKeyBGRYTBNHIDZKSP-UHFFFAOYSA-N
XLogP0.98
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 1-pentyl-2-(triazin-4-yl)hydrazine?
The IUPAC name of 1-pentyl-2-(triazin-4-yl)hydrazine (CID 67103777) is 1-pentyl-2-(triazin-4-yl)hydrazine.
What is the SMILES notation for 1-pentyl-2-(triazin-4-yl)hydrazine?
The canonical SMILES for 1-pentyl-2-(triazin-4-yl)hydrazine is CCCCCNNc1ccnnn1.
What is the InChIKey of 1-pentyl-2-(triazin-4-yl)hydrazine?
The InChIKey is BGRYTBNHIDZKSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5/c1-2-3-4-6-9-11-8-5-7-10-13-12-8/h5,7,9H,2-4,6H2,1H3,(H,10,11,12).
What are the key properties of 1-pentyl-2-(triazin-4-yl)hydrazine?
1-pentyl-2-(triazin-4-yl)hydrazine has a molecular weight of 181.24 g/mol, XLogP of 0.98, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pentyl-2-(triazin-4-yl)hydrazine is sourced from PubChem (CID 67103777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).