2-(1-methoxyisoquinolin-7-yl)morpholine

C14H16N2O2 — CID 117362678

IUPAC2-(1-methoxyisoquinolin-7-yl)morpholine
SMILESCOc1nccc2ccc(C3CNCCO3)cc12
InChIInChI=1S/C14H16N2O2/c1-17-14-12-8-11(13-9-15-6-7-18-13)3-2-10(12)4-5-16-14/h2-5,8,13,15H,6-7,9H2,1H3
InChIKeyJSJCTRSGCOFCBY-UHFFFAOYSA-N
MW244.29 g/mol
LogP1.90
Rot. Bonds2

About 2-(1-methoxyisoquinolin-7-yl)morpholine

2-(1-methoxyisoquinolin-7-yl)morpholine (PubChem CID 117362678) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-(1-methoxyisoquinolin-7-yl)morpholine.

Molecular Properties

Compound Name2-(1-methoxyisoquinolin-7-yl)morpholine
PubChem CID117362678
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-(1-methoxyisoquinolin-7-yl)morpholine
SMILESCOc1nccc2ccc(C3CNCCO3)cc12
InChIInChI=1S/C14H16N2O2/c1-17-14-12-8-11(13-9-15-6-7-18-13)3-2-10(12)4-5-16-14/h2-5,8,13,15H,6-7,9H2,1H3
InChIKeyJSJCTRSGCOFCBY-UHFFFAOYSA-N
XLogP1.90
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methoxy-7-pyrrolidin-2-ylisoquinoline
CID 117329098
2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine
CID 117346859
1-methoxy-6-piperidin-3-ylisoquinoline
CID 117358121
1-methoxy-7-(piperidin-3-ylmethyl)isoquinoline
CID 117394492
2-(3,4-dimethylphenyl)morpholine
CID 43169342
2-(3,5-dimethoxyphenyl)morpholine
CID 53414236
7-bromo-1-methoxyisoquinoline
CID 67491611
2-(3-chloro-4-ethoxyphenyl)morpholine
CID 82293187
2-(3-bromo-4-methylphenyl)morpholine
CID 83730909
2-[3-(3-methoxyphenyl)phenyl]morpholine
CID 82092915
2-(3-chloro-1-methylindazol-5-yl)morpholine
CID 117382717
2-(3-cyclohexyl-4-methoxyphenyl)morpholine
CID 117440824

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxyisoquinolin-7-yl)morpholine?
The IUPAC name of 2-(1-methoxyisoquinolin-7-yl)morpholine (CID 117362678) is 2-(1-methoxyisoquinolin-7-yl)morpholine.
What is the SMILES notation for 2-(1-methoxyisoquinolin-7-yl)morpholine?
The canonical SMILES for 2-(1-methoxyisoquinolin-7-yl)morpholine is COc1nccc2ccc(C3CNCCO3)cc12.
What is the InChIKey of 2-(1-methoxyisoquinolin-7-yl)morpholine?
The InChIKey is JSJCTRSGCOFCBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-17-14-12-8-11(13-9-15-6-7-18-13)3-2-10(12)4-5-16-14/h2-5,8,13,15H,6-7,9H2,1H3.
What are the key properties of 2-(1-methoxyisoquinolin-7-yl)morpholine?
2-(1-methoxyisoquinolin-7-yl)morpholine has a molecular weight of 244.29 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxyisoquinolin-7-yl)morpholine is sourced from PubChem (CID 117362678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).