4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine

C21H21NO4S — CID 7612861

IUPAC4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine
SMILESO=S(=O)(c1ccc(OCc2cccc3ccccc23)cc1)N1CCOCC1
InChIInChI=1S/C21H21NO4S/c23-27(24,22-12-14-25-15-13-22)20-10-8-19(9-11-20)26-16-18-6-3-5-17-4-1-2-7-21(17)18/h1-11H,12-16H2
InChIKeyFMZOBODQWGZQAX-UHFFFAOYSA-N
MW383.47 g/mol
LogP3.44
Rot. Bonds5

About 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine

4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine (PubChem CID 7612861) has the molecular formula C21H21NO4S and a molecular weight of 383.47 g/mol. Its IUPAC name is 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine
PubChem CID7612861
Molecular FormulaC21H21NO4S
Molecular Weight383.47 g/mol
Exact Mass383.12
IUPAC Name4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine
SMILESO=S(=O)(c1ccc(OCc2cccc3ccccc23)cc1)N1CCOCC1
InChIInChI=1S/C21H21NO4S/c23-27(24,22-12-14-25-15-13-22)20-10-8-19(9-11-20)26-16-18-6-3-5-17-4-1-2-7-21(17)18/h1-11H,12-16H2
InChIKeyFMZOBODQWGZQAX-UHFFFAOYSA-N
XLogP3.44
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-[(2,3-difluorophenyl)methoxy]phenyl]sulfonylmorpholine
CID 39413041
naphthalen-1-ylmethyl (E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoate
CID 6053384
4-[4-[(3-methylphenyl)methoxy]phenyl]sulfonylmorpholine
CID 9332672
4-[4-[(4-methylphenyl)methoxy]phenyl]sulfonylmorpholine
CID 9331341
4-[4-[(4-iodophenoxy)methyl]phenyl]sulfonylmorpholine
CID 1300600
4-[4-[5-(phenoxymethyl)-1,2,4-oxadiazol-3-yl]phenyl]sulfonylmorpholine
CID 46329228
N-[(2-chlorophenyl)methyl]-2-(4-morpholin-4-ylsulfonylphenoxy)acetamide
CID 27137564
4-[4-[2-(4-chlorophenoxy)ethoxy]phenyl]sulfonylmorpholine
CID 34198649
N-[(2-methoxyphenyl)methyl]-2-(4-morpholin-4-ylsulfonylphenoxy)acetamide
CID 6492353
N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-(4-pyrrolidin-1-ylsulfonylphenoxy)acetamide
CID 28562368
2-(4-morpholin-4-ylsulfonylphenoxy)-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]acetamide
CID 28562499
3-(4-morpholin-4-ylsulfonylphenyl)-N-(2-naphthalen-1-ylethyl)cycloheptan-1-amine
CID 68737457

Frequently Asked Questions

What is the IUPAC name of 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine?
The IUPAC name of 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine (CID 7612861) is 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine.
What is the SMILES notation for 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine?
The canonical SMILES for 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine is O=S(=O)(c1ccc(OCc2cccc3ccccc23)cc1)N1CCOCC1.
What is the InChIKey of 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine?
The InChIKey is FMZOBODQWGZQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO4S/c23-27(24,22-12-14-25-15-13-22)20-10-8-19(9-11-20)26-16-18-6-3-5-17-4-1-2-7-21(17)18/h1-11H,12-16H2.
What are the key properties of 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine?
4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine has a molecular weight of 383.47 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(naphthalen-1-ylmethoxy)phenyl]sulfonylmorpholine is sourced from PubChem (CID 7612861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).