1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol

C15H18N2O2 — CID 106541346

IUPAC1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol
SMILESCOc1cccc2c(N3CCC(O)CC3)nccc12
InChIInChI=1S/C15H18N2O2/c1-19-14-4-2-3-13-12(14)5-8-16-15(13)17-9-6-11(18)7-10-17/h2-5,8,11,18H,6-7,9-10H2,1H3
InChIKeyZVYZZPCFNWUNLG-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.20
Rot. Bonds2

About 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol

1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol (PubChem CID 106541346) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol
PubChem CID106541346
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol
SMILESCOc1cccc2c(N3CCC(O)CC3)nccc12
InChIInChI=1S/C15H18N2O2/c1-19-14-4-2-3-13-12(14)5-8-16-15(13)17-9-6-11(18)7-10-17/h2-5,8,11,18H,6-7,9-10H2,1H3
InChIKeyZVYZZPCFNWUNLG-UHFFFAOYSA-N
XLogP2.20
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(5-methoxyisoquinolin-1-yl)piperidin-4-yl]-N,N-dimethylacetamide
CID 136545971
3-ethyl-1-(5-methoxyisoquinolin-1-yl)piperidin-4-amine
CID 106540923
1-[3-(bromomethyl)piperidin-1-yl]-5-methoxyisoquinoline
CID 106542924
[1-(5-methoxyisoquinolin-1-yl)pyrrolidin-2-yl]methanamine
CID 106540997
5-methoxy-1-(2-methylpiperazin-1-yl)isoquinoline
CID 106542347
1-(5-methoxyisoquinolin-1-yl)piperidine-2-carbaldehyde
CID 106542383
1-[2-(bromomethyl)azepan-1-yl]-5-methoxyisoquinoline
CID 106543196
3-methoxy-2-(4-methylpiperidin-1-yl)pyridine
CID 155975394
1-[1-(5-methoxyisoquinolin-1-yl)piperidin-2-yl]-N-methylmethanamine
CID 106540539
(3S)-1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-ol
CID 104892918
1-(2-methoxy-3-pyridinyl)piperidin-4-ol
CID 172613587
N-[[1-(5-bromoisoquinolin-1-yl)piperidin-4-yl]methyl]ethanamine
CID 106540909

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol?
The IUPAC name of 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol (CID 106541346) is 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol.
What is the SMILES notation for 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol?
The canonical SMILES for 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol is COc1cccc2c(N3CCC(O)CC3)nccc12.
What is the InChIKey of 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol?
The InChIKey is ZVYZZPCFNWUNLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-19-14-4-2-3-13-12(14)5-8-16-15(13)17-9-6-11(18)7-10-17/h2-5,8,11,18H,6-7,9-10H2,1H3.
What are the key properties of 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol?
1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol has a molecular weight of 258.32 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxyisoquinolin-1-yl)piperidin-4-ol is sourced from PubChem (CID 106541346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).