N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide

C17H25N3O5S — CID 163312477

IUPACN-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide
SMILESCNC(=O)CCc1ccccc1N(CC(=O)N1CCOCC1)S(C)(=O)=O
InChIInChI=1S/C17H25N3O5S/c1-18-16(21)8-7-14-5-3-4-6-15(14)20(26(2,23)24)13-17(22)19-9-11-25-12-10-19/h3-6H,7-13H2,1-2H3,(H,18,21)
InChIKeyXUJCLRXDTRACJE-UHFFFAOYSA-N
MW383.47 g/mol
LogP-0.01
Rot. Bonds7

About N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide

N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide (PubChem CID 163312477) has the molecular formula C17H25N3O5S and a molecular weight of 383.47 g/mol. Its IUPAC name is N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide.

Molecular Properties

Compound NameN-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide
PubChem CID163312477
Molecular FormulaC17H25N3O5S
Molecular Weight383.47 g/mol
Exact Mass383.15
IUPAC NameN-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide
SMILESCNC(=O)CCc1ccccc1N(CC(=O)N1CCOCC1)S(C)(=O)=O
InChIInChI=1S/C17H25N3O5S/c1-18-16(21)8-7-14-5-3-4-6-15(14)20(26(2,23)24)13-17(22)19-9-11-25-12-10-19/h3-6H,7-13H2,1-2H3,(H,18,21)
InChIKeyXUJCLRXDTRACJE-UHFFFAOYSA-N
XLogP-0.01
TPSA96.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-chlorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 765932
N-(2-morpholin-4-yl-2-oxoethyl)-N-(2-propan-2-yloxyphenyl)methanesulfonamide
CID 113155333
ethyl 4-[2-(2-ethyl-N-methylsulfonylanilino)acetyl]piperazine-1-carboxylate
CID 1148753
N-(2,6-dichlorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 113156941
N-methyl-2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetamide
CID 30255255
N-(2-methoxyphenyl)-N-(4-morpholin-4-yl-4-oxobutyl)methanesulfonamide
CID 53288568
N-(2-morpholin-4-yl-2-oxoethyl)-N-(4-pyrazol-1-ylphenyl)methanesulfonamide
CID 162634500
N-(2,6-dimethoxy-3-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 163313438
N-(5-chloro-2-methoxyphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 1100137
N-(1-methylpyrazol-3-yl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 162634930
N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 50944502
N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-N-(2-propan-2-ylphenyl)methanesulfonamide
CID 30262751

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide?
The IUPAC name of N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide (CID 163312477) is N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide.
What is the SMILES notation for N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide?
The canonical SMILES for N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide is CNC(=O)CCc1ccccc1N(CC(=O)N1CCOCC1)S(C)(=O)=O.
What is the InChIKey of N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide?
The InChIKey is XUJCLRXDTRACJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O5S/c1-18-16(21)8-7-14-5-3-4-6-15(14)20(26(2,23)24)13-17(22)19-9-11-25-12-10-19/h3-6H,7-13H2,1-2H3,(H,18,21).
What are the key properties of N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide?
N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide has a molecular weight of 383.47 g/mol, XLogP of -0.01, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[2-[methylsulfonyl-(2-morpholin-4-yl-2-oxoethyl)amino]phenyl]propanamide is sourced from PubChem (CID 163312477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).