3-(naphthalen-1-ylmethyl)morpholine

C15H17NO — CID 66932689

IUPAC3-(naphthalen-1-ylmethyl)morpholine
SMILESc1ccc2c(CC3COCCN3)cccc2c1
InChIInChI=1S/C15H17NO/c1-2-7-15-12(4-1)5-3-6-13(15)10-14-11-17-9-8-16-14/h1-7,14,16H,8-11H2
InChIKeyBWJGHJXEKSAXFU-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.37
Rot. Bonds2

About 3-(naphthalen-1-ylmethyl)morpholine

3-(naphthalen-1-ylmethyl)morpholine (PubChem CID 66932689) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-(naphthalen-1-ylmethyl)morpholine.

Molecular Properties

Compound Name3-(naphthalen-1-ylmethyl)morpholine
PubChem CID66932689
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name3-(naphthalen-1-ylmethyl)morpholine
SMILESc1ccc2c(CC3COCCN3)cccc2c1
InChIInChI=1S/C15H17NO/c1-2-7-15-12(4-1)5-3-6-13(15)10-14-11-17-9-8-16-14/h1-7,14,16H,8-11H2
InChIKeyBWJGHJXEKSAXFU-UHFFFAOYSA-N
XLogP2.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(naphthalen-1-ylmethyl)morpholine?
The IUPAC name of 3-(naphthalen-1-ylmethyl)morpholine (CID 66932689) is 3-(naphthalen-1-ylmethyl)morpholine.
What is the SMILES notation for 3-(naphthalen-1-ylmethyl)morpholine?
The canonical SMILES for 3-(naphthalen-1-ylmethyl)morpholine is c1ccc2c(CC3COCCN3)cccc2c1.
What is the InChIKey of 3-(naphthalen-1-ylmethyl)morpholine?
The InChIKey is BWJGHJXEKSAXFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-2-7-15-12(4-1)5-3-6-13(15)10-14-11-17-9-8-16-14/h1-7,14,16H,8-11H2.
What are the key properties of 3-(naphthalen-1-ylmethyl)morpholine?
3-(naphthalen-1-ylmethyl)morpholine has a molecular weight of 227.31 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(naphthalen-1-ylmethyl)morpholine is sourced from PubChem (CID 66932689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).