1,2,3,4-tetrahydronaphthalene;triazine

C13H15N3 — CID 22467693

IUPAC1,2,3,4-tetrahydronaphthalene;triazine
SMILESc1ccc2c(c1)CCCC2.c1cnnnc1
InChIInChI=1S/C10H12.C3H3N3/c1-2-6-10-8-4-3-7-9(10)5-1;1-2-4-6-5-3-1/h1-2,5-6H,3-4,7-8H2;1-3H
InChIKeyXFNOSWZAZGPLAS-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.44
Rot. Bonds

About 1,2,3,4-tetrahydronaphthalene;triazine

1,2,3,4-tetrahydronaphthalene;triazine (PubChem CID 22467693) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 1,2,3,4-tetrahydronaphthalene;triazine.

Molecular Properties

Compound Name1,2,3,4-tetrahydronaphthalene;triazine
PubChem CID22467693
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name1,2,3,4-tetrahydronaphthalene;triazine
SMILESc1ccc2c(c1)CCCC2.c1cnnnc1
InChIInChI=1S/C10H12.C3H3N3/c1-2-6-10-8-4-3-7-9(10)5-1;1-2-4-6-5-3-1/h1-2,5-6H,3-4,7-8H2;1-3H
InChIKeyXFNOSWZAZGPLAS-UHFFFAOYSA-N
XLogP2.44
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydronaphthalene;triazine?
The IUPAC name of 1,2,3,4-tetrahydronaphthalene;triazine (CID 22467693) is 1,2,3,4-tetrahydronaphthalene;triazine.
What is the SMILES notation for 1,2,3,4-tetrahydronaphthalene;triazine?
The canonical SMILES for 1,2,3,4-tetrahydronaphthalene;triazine is c1ccc2c(c1)CCCC2.c1cnnnc1.
What is the InChIKey of 1,2,3,4-tetrahydronaphthalene;triazine?
The InChIKey is XFNOSWZAZGPLAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12.C3H3N3/c1-2-6-10-8-4-3-7-9(10)5-1;1-2-4-6-5-3-1/h1-2,5-6H,3-4,7-8H2;1-3H.
What are the key properties of 1,2,3,4-tetrahydronaphthalene;triazine?
1,2,3,4-tetrahydronaphthalene;triazine has a molecular weight of 213.28 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydronaphthalene;triazine is sourced from PubChem (CID 22467693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).