sodium;hydride;4-piperazin-1-ylquinolin-7-ol

C13H16N3NaO — CID 173028070

IUPACsodium;hydride;4-piperazin-1-ylquinolin-7-ol
SMILESOc1ccc2c(N3CCNCC3)ccnc2c1.[H-].[Na+]
InChIInChI=1S/C13H15N3O.Na.H/c17-10-1-2-11-12(9-10)15-4-3-13(11)16-7-5-14-6-8-16;;/h1-4,9,14,17H,5-8H2;;/q;+1;-1
InChIKeyUUZCGGBCCATSJL-UHFFFAOYSA-N
MW253.28 g/mol
LogP-1.53
Rot. Bonds1

About sodium;hydride;4-piperazin-1-ylquinolin-7-ol

sodium;hydride;4-piperazin-1-ylquinolin-7-ol (PubChem CID 173028070) has the molecular formula C13H16N3NaO and a molecular weight of 253.28 g/mol. Its IUPAC name is sodium;hydride;4-piperazin-1-ylquinolin-7-ol.

Molecular Properties

Compound Namesodium;hydride;4-piperazin-1-ylquinolin-7-ol
PubChem CID173028070
Molecular FormulaC13H16N3NaO
Molecular Weight253.28 g/mol
Exact Mass253.12
IUPAC Namesodium;hydride;4-piperazin-1-ylquinolin-7-ol
SMILESOc1ccc2c(N3CCNCC3)ccnc2c1.[H-].[Na+]
InChIInChI=1S/C13H15N3O.Na.H/c17-10-1-2-11-12(9-10)15-4-3-13(11)16-7-5-14-6-8-16;;/h1-4,9,14,17H,5-8H2;;/q;+1;-1
InChIKeyUUZCGGBCCATSJL-UHFFFAOYSA-N
XLogP-1.53
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 5-1.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of sodium;hydride;4-piperazin-1-ylquinolin-7-ol?
The IUPAC name of sodium;hydride;4-piperazin-1-ylquinolin-7-ol (CID 173028070) is sodium;hydride;4-piperazin-1-ylquinolin-7-ol.
What is the SMILES notation for sodium;hydride;4-piperazin-1-ylquinolin-7-ol?
The canonical SMILES for sodium;hydride;4-piperazin-1-ylquinolin-7-ol is Oc1ccc2c(N3CCNCC3)ccnc2c1.[H-].[Na+].
What is the InChIKey of sodium;hydride;4-piperazin-1-ylquinolin-7-ol?
The InChIKey is UUZCGGBCCATSJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O.Na.H/c17-10-1-2-11-12(9-10)15-4-3-13(11)16-7-5-14-6-8-16;;/h1-4,9,14,17H,5-8H2;;/q;+1;-1.
What are the key properties of sodium;hydride;4-piperazin-1-ylquinolin-7-ol?
sodium;hydride;4-piperazin-1-ylquinolin-7-ol has a molecular weight of 253.28 g/mol, XLogP of -1.53, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;4-piperazin-1-ylquinolin-7-ol is sourced from PubChem (CID 173028070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).