7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine

C8H12N8 — CID 91698277

IUPAC7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine
SMILESNc1nc(N2CCCCC2)n2nnnc2n1
InChIInChI=1S/C8H12N8/c9-6-10-7-12-13-14-16(7)8(11-6)15-4-2-1-3-5-15/h1-5H2,(H2,9,10,12,14)
InChIKeyKAGXRYFIGZAQOX-UHFFFAOYSA-N
MW220.24 g/mol
LogP-0.51
Rot. Bonds1

About 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine

7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine (PubChem CID 91698277) has the molecular formula C8H12N8 and a molecular weight of 220.24 g/mol. Its IUPAC name is 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine.

Molecular Properties

Compound Name7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine
PubChem CID91698277
Molecular FormulaC8H12N8
Molecular Weight220.24 g/mol
Exact Mass220.12
IUPAC Name7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine
SMILESNc1nc(N2CCCCC2)n2nnnc2n1
InChIInChI=1S/C8H12N8/c9-6-10-7-12-13-14-16(7)8(11-6)15-4-2-1-3-5-15/h1-5H2,(H2,9,10,12,14)
InChIKeyKAGXRYFIGZAQOX-UHFFFAOYSA-N
XLogP-0.51
TPSA98.12 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

CID 127043770
CID 127043770
CID 80764303
CID 80764303
CID 102585359
CID 102585359

Frequently Asked Questions

What is the IUPAC name of 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine?
The IUPAC name of 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine (CID 91698277) is 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine.
What is the SMILES notation for 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine?
The canonical SMILES for 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine is Nc1nc(N2CCCCC2)n2nnnc2n1.
What is the InChIKey of 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine?
The InChIKey is KAGXRYFIGZAQOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N8/c9-6-10-7-12-13-14-16(7)8(11-6)15-4-2-1-3-5-15/h1-5H2,(H2,9,10,12,14).
What are the key properties of 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine?
7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine has a molecular weight of 220.24 g/mol, XLogP of -0.51, 1 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-piperidin-1-yltetrazolo[1,5-a][1,3,5]triazin-5-amine is sourced from PubChem (CID 91698277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).