N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide

C13H19N3O5S — CID 165427573

IUPACN-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
SMILESCOc1cc(N(CC(=O)N2CCOCC2)S(C)(=O)=O)ccn1
InChIInChI=1S/C13H19N3O5S/c1-20-12-9-11(3-4-14-12)16(22(2,18)19)10-13(17)15-5-7-21-8-6-15/h3-4,9H,5-8,10H2,1-2H3
InChIKeySTKZUHGQOPAWPT-UHFFFAOYSA-N
MW329.38 g/mol
LogP-0.28
Rot. Bonds5

About N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide

N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide (PubChem CID 165427573) has the molecular formula C13H19N3O5S and a molecular weight of 329.38 g/mol. Its IUPAC name is N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
PubChem CID165427573
Molecular FormulaC13H19N3O5S
Molecular Weight329.38 g/mol
Exact Mass329.10
IUPAC NameN-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
SMILESCOc1cc(N(CC(=O)N2CCOCC2)S(C)(=O)=O)ccn1
InChIInChI=1S/C13H19N3O5S/c1-20-12-9-11(3-4-14-12)16(22(2,18)19)10-13(17)15-5-7-21-8-6-15/h3-4,9H,5-8,10H2,1-2H3
InChIKeySTKZUHGQOPAWPT-UHFFFAOYSA-N
XLogP-0.28
TPSA89.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 5-0.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,6-dimethoxy-3-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 163313438
N-(2-morpholin-4-yl-2-oxoethyl)-N-(4-pyrazol-1-ylphenyl)methanesulfonamide
CID 162634500
N-(5-chloro-2-methoxyphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 1100137
N-(2-morpholin-4-yl-2-oxoethyl)-N-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 50944502
N-(2,6-dichlorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 113156941
N-(1-methylpyrazol-3-yl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 162634930
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide
CID 113156552
N-(3,4-dimethoxyphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]methanesulfonamide
CID 1085637
N-(2-chloro-4,6-dimethylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 113155009
N-(1,3-benzodioxol-5-yl)-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]methanesulfonamide
CID 6488919
N-(2-chlorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 765932
N-(3-methylphenyl)-N-(3-morpholin-4-yl-3-oxopropyl)methanesulfonamide
CID 113141742

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide?
The IUPAC name of N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide (CID 165427573) is N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide.
What is the SMILES notation for N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide?
The canonical SMILES for N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide is COc1cc(N(CC(=O)N2CCOCC2)S(C)(=O)=O)ccn1.
What is the InChIKey of N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide?
The InChIKey is STKZUHGQOPAWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O5S/c1-20-12-9-11(3-4-14-12)16(22(2,18)19)10-13(17)15-5-7-21-8-6-15/h3-4,9H,5-8,10H2,1-2H3.
What are the key properties of N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide?
N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide has a molecular weight of 329.38 g/mol, XLogP of -0.28, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-4-pyridinyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide is sourced from PubChem (CID 165427573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).