7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline

C14H20N2 — CID 56992397

IUPAC7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline
SMILESC1=CC2=CCC(N3CCCCC3)CC2N=C1
InChIInChI=1S/C14H20N2/c1-2-9-16(10-3-1)13-7-6-12-5-4-8-15-14(12)11-13/h4-6,8,13-14H,1-3,7,9-11H2
InChIKeyQEFVECSKXAGXRA-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.57
Rot. Bonds1

About 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline

7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline (PubChem CID 56992397) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline.

Molecular Properties

Compound Name7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline
PubChem CID56992397
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline
SMILESC1=CC2=CCC(N3CCCCC3)CC2N=C1
InChIInChI=1S/C14H20N2/c1-2-9-16(10-3-1)13-7-6-12-5-4-8-15-14(12)11-13/h4-6,8,13-14H,1-3,7,9-11H2
InChIKeyQEFVECSKXAGXRA-UHFFFAOYSA-N
XLogP2.57
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline?
The IUPAC name of 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline (CID 56992397) is 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline.
What is the SMILES notation for 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline?
The canonical SMILES for 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline is C1=CC2=CCC(N3CCCCC3)CC2N=C1.
What is the InChIKey of 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline?
The InChIKey is QEFVECSKXAGXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-2-9-16(10-3-1)13-7-6-12-5-4-8-15-14(12)11-13/h4-6,8,13-14H,1-3,7,9-11H2.
What are the key properties of 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline?
7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline has a molecular weight of 216.33 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-piperidin-1-yl-6,7,8,8a-tetrahydroquinoline is sourced from PubChem (CID 56992397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).