N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide

C20H24N2O4S — CID 110352918

IUPACN-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide
SMILESCc1ccc(CS(=O)(=O)Nc2cccc(C(=O)N3CCOCC3C)c2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-6-8-17(9-7-15)14-27(24,25)21-19-5-3-4-18(12-19)20(23)22-10-11-26-13-16(22)2/h3-9,12,16,21H,10-11,13-14H2,1-2H3
InChIKeySUDVJRVDXKBZQT-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.80
Rot. Bonds5

About N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide

N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide (PubChem CID 110352918) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide
PubChem CID110352918
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC NameN-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide
SMILESCc1ccc(CS(=O)(=O)Nc2cccc(C(=O)N3CCOCC3C)c2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-6-8-17(9-7-15)14-27(24,25)21-19-5-3-4-18(12-19)20(23)22-10-11-26-13-16(22)2/h3-9,12,16,21H,10-11,13-14H2,1-2H3
InChIKeySUDVJRVDXKBZQT-UHFFFAOYSA-N
XLogP2.80
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-2-phenylethanesulfonamide
CID 110352919
(3-methylmorpholin-4-yl)-[3-(propan-2-ylsulfamoylamino)phenyl]methanone
CID 110614469
N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-2-(3-methylphenyl)acetamide
CID 110671847
[3-(cyclopentylsulfamoylamino)phenyl]-(3-methylmorpholin-4-yl)methanone
CID 110614470
2-(4-chlorophenyl)-N-[3-(3-methylmorpholine-4-carbonyl)phenyl]acetamide
CID 110352861
2-ethyl-N-[3-(3-methylmorpholine-4-carbonyl)phenyl]butanamide
CID 110352840
1-(3-chlorophenyl)-3-[3-(3-methylmorpholine-4-carbonyl)phenyl]urea
CID 110352872
N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-5-oxopyrrolidine-2-carboxamide
CID 110671836
2-(2-chlorophenyl)-N-[3-(3-methylmorpholine-4-carbonyl)phenyl]acetamide
CID 110671851
N,N-dimethyl-3-(3-methylmorpholine-4-carbonyl)benzenesulfonamide
CID 110354676
(3-methylmorpholin-4-yl)-(3-phenylphenyl)methanone
CID 110292242
N-[4-(3-methylmorpholine-4-carbonyl)phenyl]methanesulfonamide
CID 47174328

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide?
The IUPAC name of N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide (CID 110352918) is N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide.
What is the SMILES notation for N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide?
The canonical SMILES for N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide is Cc1ccc(CS(=O)(=O)Nc2cccc(C(=O)N3CCOCC3C)c2)cc1.
What is the InChIKey of N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide?
The InChIKey is SUDVJRVDXKBZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-15-6-8-17(9-7-15)14-27(24,25)21-19-5-3-4-18(12-19)20(23)22-10-11-26-13-16(22)2/h3-9,12,16,21H,10-11,13-14H2,1-2H3.
What are the key properties of N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide?
N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide has a molecular weight of 388.49 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-methylmorpholine-4-carbonyl)phenyl]-1-(4-methylphenyl)methanesulfonamide is sourced from PubChem (CID 110352918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).