2-(4-phenylpiperazin-1-yl)quinolin-8-ol

C19H19N3O — CID 16812500

IUPAC2-(4-phenylpiperazin-1-yl)quinolin-8-ol
SMILESOc1cccc2ccc(N3CCN(c4ccccc4)CC3)nc12
InChIInChI=1S/C19H19N3O/c23-17-8-4-5-15-9-10-18(20-19(15)17)22-13-11-21(12-14-22)16-6-2-1-3-7-16/h1-10,23H,11-14H2
InChIKeyNLEBIHHGSQJBTM-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.27
Rot. Bonds2

About 2-(4-phenylpiperazin-1-yl)quinolin-8-ol

2-(4-phenylpiperazin-1-yl)quinolin-8-ol (PubChem CID 16812500) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-(4-phenylpiperazin-1-yl)quinolin-8-ol.

Molecular Properties

Compound Name2-(4-phenylpiperazin-1-yl)quinolin-8-ol
PubChem CID16812500
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name2-(4-phenylpiperazin-1-yl)quinolin-8-ol
SMILESOc1cccc2ccc(N3CCN(c4ccccc4)CC3)nc12
InChIInChI=1S/C19H19N3O/c23-17-8-4-5-15-9-10-18(20-19(15)17)22-13-11-21(12-14-22)16-6-2-1-3-7-16/h1-10,23H,11-14H2
InChIKeyNLEBIHHGSQJBTM-UHFFFAOYSA-N
XLogP3.27
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylpiperazin-1-yl)quinolin-8-ol?
The IUPAC name of 2-(4-phenylpiperazin-1-yl)quinolin-8-ol (CID 16812500) is 2-(4-phenylpiperazin-1-yl)quinolin-8-ol.
What is the SMILES notation for 2-(4-phenylpiperazin-1-yl)quinolin-8-ol?
The canonical SMILES for 2-(4-phenylpiperazin-1-yl)quinolin-8-ol is Oc1cccc2ccc(N3CCN(c4ccccc4)CC3)nc12.
What is the InChIKey of 2-(4-phenylpiperazin-1-yl)quinolin-8-ol?
The InChIKey is NLEBIHHGSQJBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c23-17-8-4-5-15-9-10-18(20-19(15)17)22-13-11-21(12-14-22)16-6-2-1-3-7-16/h1-10,23H,11-14H2.
What are the key properties of 2-(4-phenylpiperazin-1-yl)quinolin-8-ol?
2-(4-phenylpiperazin-1-yl)quinolin-8-ol has a molecular weight of 305.38 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylpiperazin-1-yl)quinolin-8-ol is sourced from PubChem (CID 16812500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).