4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline

C18H20N2 — CID 141320772

IUPAC4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline
SMILESc1cc(-c2ccnc3c2CCCC3)c2c(n1)CCCC2
InChIInChI=1S/C18H20N2/c1-3-7-17-15(5-1)13(9-11-19-17)14-10-12-20-18-8-4-2-6-16(14)18/h9-12H,1-8H2
InChIKeyKVQUJOXTTHAVJE-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.90
Rot. Bonds1

About 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline

4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline (PubChem CID 141320772) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline
PubChem CID141320772
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC Name4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline
SMILESc1cc(-c2ccnc3c2CCCC3)c2c(n1)CCCC2
InChIInChI=1S/C18H20N2/c1-3-7-17-15(5-1)13(9-11-19-17)14-10-12-20-18-8-4-2-6-16(14)18/h9-12H,1-8H2
InChIKeyKVQUJOXTTHAVJE-UHFFFAOYSA-N
XLogP3.90
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline (CID 141320772) is 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline is c1cc(-c2ccnc3c2CCCC3)c2c(n1)CCCC2.
What is the InChIKey of 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline?
The InChIKey is KVQUJOXTTHAVJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2/c1-3-7-17-15(5-1)13(9-11-19-17)14-10-12-20-18-8-4-2-6-16(14)18/h9-12H,1-8H2.
What are the key properties of 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline?
4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline has a molecular weight of 264.37 g/mol, XLogP of 3.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,6,7,8-tetrahydroquinolin-4-yl)-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 141320772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).