2,4-dimethyl-2-naphthalen-1-ylmorpholine

C16H19NO — CID 3066055

IUPAC2,4-dimethyl-2-naphthalen-1-ylmorpholine
SMILESCN1CCOC(C)(c2cccc3ccccc23)C1
InChIInChI=1S/C16H19NO/c1-16(12-17(2)10-11-18-16)15-9-5-7-13-6-3-4-8-14(13)15/h3-9H,10-12H2,1-2H3
InChIKeySVNZXNWNRJYDLH-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.02
Rot. Bonds1

About 2,4-dimethyl-2-naphthalen-1-ylmorpholine

2,4-dimethyl-2-naphthalen-1-ylmorpholine (PubChem CID 3066055) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2,4-dimethyl-2-naphthalen-1-ylmorpholine.

Molecular Properties

Compound Name2,4-dimethyl-2-naphthalen-1-ylmorpholine
PubChem CID3066055
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2,4-dimethyl-2-naphthalen-1-ylmorpholine
SMILESCN1CCOC(C)(c2cccc3ccccc23)C1
InChIInChI=1S/C16H19NO/c1-16(12-17(2)10-11-18-16)15-9-5-7-13-6-3-4-8-14(13)15/h3-9H,10-12H2,1-2H3
InChIKeySVNZXNWNRJYDLH-UHFFFAOYSA-N
XLogP3.02
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-2-naphthalen-1-ylmorpholine?
The IUPAC name of 2,4-dimethyl-2-naphthalen-1-ylmorpholine (CID 3066055) is 2,4-dimethyl-2-naphthalen-1-ylmorpholine.
What is the SMILES notation for 2,4-dimethyl-2-naphthalen-1-ylmorpholine?
The canonical SMILES for 2,4-dimethyl-2-naphthalen-1-ylmorpholine is CN1CCOC(C)(c2cccc3ccccc23)C1.
What is the InChIKey of 2,4-dimethyl-2-naphthalen-1-ylmorpholine?
The InChIKey is SVNZXNWNRJYDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-16(12-17(2)10-11-18-16)15-9-5-7-13-6-3-4-8-14(13)15/h3-9H,10-12H2,1-2H3.
What are the key properties of 2,4-dimethyl-2-naphthalen-1-ylmorpholine?
2,4-dimethyl-2-naphthalen-1-ylmorpholine has a molecular weight of 241.33 g/mol, XLogP of 3.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-2-naphthalen-1-ylmorpholine is sourced from PubChem (CID 3066055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).