7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline

C19H18ClN3 — CID 67035242

IUPAC7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline
SMILESClc1cccc(-c2ccc3ncc(N4CCCCC4)nc3c2)c1
InChIInChI=1S/C19H18ClN3/c20-16-6-4-5-14(11-16)15-7-8-17-18(12-15)22-19(13-21-17)23-9-2-1-3-10-23/h4-8,11-13H,1-3,9-10H2
InChIKeyLIFPJNICJLJYJF-UHFFFAOYSA-N
MW323.83 g/mol
LogP4.94
Rot. Bonds2

About 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline

7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline (PubChem CID 67035242) has the molecular formula C19H18ClN3 and a molecular weight of 323.83 g/mol. Its IUPAC name is 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline.

Molecular Properties

Compound Name7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline
PubChem CID67035242
Molecular FormulaC19H18ClN3
Molecular Weight323.83 g/mol
Exact Mass323.12
IUPAC Name7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline
SMILESClc1cccc(-c2ccc3ncc(N4CCCCC4)nc3c2)c1
InChIInChI=1S/C19H18ClN3/c20-16-6-4-5-14(11-16)15-7-8-17-18(12-15)22-19(13-21-17)23-9-2-1-3-10-23/h4-8,11-13H,1-3,9-10H2
InChIKeyLIFPJNICJLJYJF-UHFFFAOYSA-N
XLogP4.94
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.83
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline?
The IUPAC name of 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline (CID 67035242) is 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline.
What is the SMILES notation for 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline?
The canonical SMILES for 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline is Clc1cccc(-c2ccc3ncc(N4CCCCC4)nc3c2)c1.
What is the InChIKey of 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline?
The InChIKey is LIFPJNICJLJYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3/c20-16-6-4-5-14(11-16)15-7-8-17-18(12-15)22-19(13-21-17)23-9-2-1-3-10-23/h4-8,11-13H,1-3,9-10H2.
What are the key properties of 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline?
7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline has a molecular weight of 323.83 g/mol, XLogP of 4.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-chlorophenyl)-2-piperidin-1-ylquinoxaline is sourced from PubChem (CID 67035242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).