2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline

C14H14N2 — CID 59083928

IUPAC2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline
SMILESc1cncc(-c2ccc3c(n2)CCCC3)c1
InChIInChI=1S/C14H14N2/c1-2-6-13-11(4-1)7-8-14(16-13)12-5-3-9-15-10-12/h3,5,7-10H,1-2,4,6H2
InChIKeyXQQDHRCQWJDCAP-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.02
Rot. Bonds1

About 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline

2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline (PubChem CID 59083928) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline
PubChem CID59083928
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline
SMILESc1cncc(-c2ccc3c(n2)CCCC3)c1
InChIInChI=1S/C14H14N2/c1-2-6-13-11(4-1)7-8-14(16-13)12-5-3-9-15-10-12/h3,5,7-10H,1-2,4,6H2
InChIKeyXQQDHRCQWJDCAP-UHFFFAOYSA-N
XLogP3.02
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline (CID 59083928) is 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline is c1cncc(-c2ccc3c(n2)CCCC3)c1.
What is the InChIKey of 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline?
The InChIKey is XQQDHRCQWJDCAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c1-2-6-13-11(4-1)7-8-14(16-13)12-5-3-9-15-10-12/h3,5,7-10H,1-2,4,6H2.
What are the key properties of 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline?
2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline has a molecular weight of 210.28 g/mol, XLogP of 3.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 59083928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).