4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol

C16H19NO3 — CID 70584076

IUPAC4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol
SMILESCOc1cc(CC2CNCCO2)c(O)c2ccccc12
InChIInChI=1S/C16H19NO3/c1-19-15-9-11(8-12-10-17-6-7-20-12)16(18)14-5-3-2-4-13(14)15/h2-5,9,12,17-18H,6-8,10H2,1H3
InChIKeySZIHMLXLIHDCAI-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.08
Rot. Bonds3

About 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol

4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol (PubChem CID 70584076) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol.

Molecular Properties

Compound Name4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol
PubChem CID70584076
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol
SMILESCOc1cc(CC2CNCCO2)c(O)c2ccccc12
InChIInChI=1S/C16H19NO3/c1-19-15-9-11(8-12-10-17-6-7-20-12)16(18)14-5-3-2-4-13(14)15/h2-5,9,12,17-18H,6-8,10H2,1H3
InChIKeySZIHMLXLIHDCAI-UHFFFAOYSA-N
XLogP2.08
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol?
The IUPAC name of 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol (CID 70584076) is 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol.
What is the SMILES notation for 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol?
The canonical SMILES for 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol is COc1cc(CC2CNCCO2)c(O)c2ccccc12.
What is the InChIKey of 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol?
The InChIKey is SZIHMLXLIHDCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-19-15-9-11(8-12-10-17-6-7-20-12)16(18)14-5-3-2-4-13(14)15/h2-5,9,12,17-18H,6-8,10H2,1H3.
What are the key properties of 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol?
4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol has a molecular weight of 273.33 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(morpholin-2-ylmethyl)naphthalen-1-ol is sourced from PubChem (CID 70584076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).