8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline

C14H14N2O — CID 61025631

IUPAC8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline
SMILESc1ccc(Oc2cccc3c2NCCC3)nc1
InChIInChI=1S/C14H14N2O/c1-2-9-15-13(8-1)17-12-7-3-5-11-6-4-10-16-14(11)12/h1-3,5,7-9,16H,4,6,10H2
InChIKeyQVVBFFWTAZZFAQ-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.23
Rot. Bonds2

About 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline

8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline (PubChem CID 61025631) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline
PubChem CID61025631
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline
SMILESc1ccc(Oc2cccc3c2NCCC3)nc1
InChIInChI=1S/C14H14N2O/c1-2-9-15-13(8-1)17-12-7-3-5-11-6-4-10-16-14(11)12/h1-3,5,7-9,16H,4,6,10H2
InChIKeyQVVBFFWTAZZFAQ-UHFFFAOYSA-N
XLogP3.23
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline (CID 61025631) is 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline is c1ccc(Oc2cccc3c2NCCC3)nc1.
What is the InChIKey of 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline?
The InChIKey is QVVBFFWTAZZFAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-2-9-15-13(8-1)17-12-7-3-5-11-6-4-10-16-14(11)12/h1-3,5,7-9,16H,4,6,10H2.
What are the key properties of 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline?
8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline has a molecular weight of 226.28 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-pyridin-2-yloxy-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 61025631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).