4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide

C19H23N3O4S — CID 46581324

IUPAC4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide
SMILESCCc1ccc(C(=O)Nc2cccc(C)n2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H23N3O4S/c1-3-15-7-8-16(19(23)21-18-6-4-5-14(2)20-18)13-17(15)27(24,25)22-9-11-26-12-10-22/h4-8,13H,3,9-12H2,1-2H3,(H,20,21,23)
InChIKeyLORWUUUDVPLGNE-UHFFFAOYSA-N
MW389.48 g/mol
LogP2.23
Rot. Bonds5

About 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide

4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide (PubChem CID 46581324) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound Name4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide
PubChem CID46581324
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC Name4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide
SMILESCCc1ccc(C(=O)Nc2cccc(C)n2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H23N3O4S/c1-3-15-7-8-16(19(23)21-18-6-4-5-14(2)20-18)13-17(15)27(24,25)22-9-11-26-12-10-22/h4-8,13H,3,9-12H2,1-2H3,(H,20,21,23)
InChIKeyLORWUUUDVPLGNE-UHFFFAOYSA-N
XLogP2.23
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-4-ethyl-3-morpholin-4-ylsulfonylbenzamide
CID 43059698
N-(2-chloro-4-methylphenyl)-4-ethyl-3-morpholin-4-ylsulfonylbenzamide
CID 46584228
methyl 4-[(4-ethyl-3-morpholin-4-ylsulfonylbenzoyl)amino]benzoate
CID 30839746
N-(5-chloro-2-methylphenyl)-4-ethyl-3-morpholin-4-ylsulfonylbenzamide
CID 46581514
N-butan-2-yl-4-ethyl-3-morpholin-4-ylsulfonylbenzamide
CID 46584081
4-ethyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-morpholin-4-ylsulfonylbenzamide
CID 30838011
N-(2,6-diethylphenyl)-4-fluoro-3-morpholin-4-ylsulfonylbenzamide
CID 2161635
N-(2-amino-2-methylpropyl)-4-ethyl-3-morpholin-4-ylsulfonylbenzamide
CID 119626593
4-ethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-morpholin-4-ylsulfonylbenzamide
CID 43058965
4-ethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-3-morpholin-4-ylsulfonylbenzamide
CID 30840501
N-[2-(difluoromethylsulfanyl)phenyl]-4-ethyl-3-morpholin-4-ylsulfonylbenzamide
CID 30840402
4-ethyl-3-morpholin-4-ylsulfonyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 43058895

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide (CID 46581324) is 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide is CCc1ccc(C(=O)Nc2cccc(C)n2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide?
The InChIKey is LORWUUUDVPLGNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-3-15-7-8-16(19(23)21-18-6-4-5-14(2)20-18)13-17(15)27(24,25)22-9-11-26-12-10-22/h4-8,13H,3,9-12H2,1-2H3,(H,20,21,23).
What are the key properties of 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide?
4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide has a molecular weight of 389.48 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(6-methyl-2-pyridinyl)-3-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 46581324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).