N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide

C23H24N2O5S — CID 26065527

IUPACN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C23H24N2O5S/c1-29-22-9-8-20(31(27,28)25-10-12-30-13-11-25)16-21(22)24-23(26)15-17-6-7-18-4-2-3-5-19(18)14-17/h2-9,14,16H,10-13,15H2,1H3,(H,24,26)
InChIKeyVAQAFAHNVACLOX-UHFFFAOYSA-N
MW440.52 g/mol
LogP3.05
Rot. Bonds6

About N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide

N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide (PubChem CID 26065527) has the molecular formula C23H24N2O5S and a molecular weight of 440.52 g/mol. Its IUPAC name is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide
PubChem CID26065527
Molecular FormulaC23H24N2O5S
Molecular Weight440.52 g/mol
Exact Mass440.14
IUPAC NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C23H24N2O5S/c1-29-22-9-8-20(31(27,28)25-10-12-30-13-11-25)16-21(22)24-23(26)15-17-6-7-18-4-2-3-5-19(18)14-17/h2-9,14,16H,10-13,15H2,1H3,(H,24,26)
InChIKeyVAQAFAHNVACLOX-UHFFFAOYSA-N
XLogP3.05
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.52
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide?
The IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide (CID 26065527) is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide is COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)Cc1ccc2ccccc2c1.
What is the InChIKey of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide?
The InChIKey is VAQAFAHNVACLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O5S/c1-29-22-9-8-20(31(27,28)25-10-12-30-13-11-25)16-21(22)24-23(26)15-17-6-7-18-4-2-3-5-19(18)14-17/h2-9,14,16H,10-13,15H2,1H3,(H,24,26).
What are the key properties of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide?
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide has a molecular weight of 440.52 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 26065527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).