7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline

C20H19N3O — CID 10018725

IUPAC7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline
SMILESc1ccc2c(c1)OCc1c(N3CCNCC3)nc3ccccc3c1-2
InChIInChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
InChIKeyUUHGENRJAPGWMG-UHFFFAOYSA-N
MW317.39 g/mol
LogP3.20
Rot. Bonds1

About 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline

7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline (PubChem CID 10018725) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline.

Molecular Properties

Compound Name7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline
PubChem CID10018725
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC Name7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline
SMILESc1ccc2c(c1)OCc1c(N3CCNCC3)nc3ccccc3c1-2
InChIInChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
InChIKeyUUHGENRJAPGWMG-UHFFFAOYSA-N
XLogP3.20
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline?
The IUPAC name of 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline (CID 10018725) is 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline.
What is the SMILES notation for 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline?
The canonical SMILES for 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline is c1ccc2c(c1)OCc1c(N3CCNCC3)nc3ccccc3c1-2.
What is the InChIKey of 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline?
The InChIKey is UUHGENRJAPGWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2.
What are the key properties of 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline?
7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline has a molecular weight of 317.39 g/mol, XLogP of 3.20, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-piperazin-1-yl-6H-chromeno[3,4-c]quinoline is sourced from PubChem (CID 10018725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).