1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine

C11H13N5 — CID 79506698

IUPAC1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine
SMILESNc1nnnn1-c1cccc2c1CCCC2
InChIInChI=1S/C11H13N5/c12-11-13-14-15-16(11)10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2,(H2,12,13,15)
InChIKeyYBFMDYJGEMPQDK-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.12
Rot. Bonds1

About 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine

1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine (PubChem CID 79506698) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine.

Molecular Properties

Compound Name1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine
PubChem CID79506698
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC Name1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine
SMILESNc1nnnn1-c1cccc2c1CCCC2
InChIInChI=1S/C11H13N5/c12-11-13-14-15-16(11)10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2,(H2,12,13,15)
InChIKeyYBFMDYJGEMPQDK-UHFFFAOYSA-N
XLogP1.12
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-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 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine?
The IUPAC name of 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine (CID 79506698) is 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine.
What is the SMILES notation for 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine?
The canonical SMILES for 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine is Nc1nnnn1-c1cccc2c1CCCC2.
What is the InChIKey of 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine?
The InChIKey is YBFMDYJGEMPQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5/c12-11-13-14-15-16(11)10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6H2,(H2,12,13,15).
What are the key properties of 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine?
1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine has a molecular weight of 215.26 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6,7,8-tetrahydronaphthalen-1-yl)tetrazol-5-amine is sourced from PubChem (CID 79506698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).