2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide

C18H21N3O4S — CID 24997264

IUPAC2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide
SMILESCc1ccc(C(=O)NS(=O)(=O)c2ccc(N3CCOCC3)nc2)c(C)c1
InChIInChI=1S/C18H21N3O4S/c1-13-3-5-16(14(2)11-13)18(22)20-26(23,24)15-4-6-17(19-12-15)21-7-9-25-10-8-21/h3-6,11-12H,7-10H2,1-2H3,(H,20,22)
InChIKeyBAVZFAJKPWGJAR-UHFFFAOYSA-N
MW375.45 g/mol
LogP1.65
Rot. Bonds4

About 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide

2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide (PubChem CID 24997264) has the molecular formula C18H21N3O4S and a molecular weight of 375.45 g/mol. Its IUPAC name is 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide
PubChem CID24997264
Molecular FormulaC18H21N3O4S
Molecular Weight375.45 g/mol
Exact Mass375.13
IUPAC Name2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide
SMILESCc1ccc(C(=O)NS(=O)(=O)c2ccc(N3CCOCC3)nc2)c(C)c1
InChIInChI=1S/C18H21N3O4S/c1-13-3-5-16(14(2)11-13)18(22)20-26(23,24)15-4-6-17(19-12-15)21-7-9-25-10-8-21/h3-6,11-12H,7-10H2,1-2H3,(H,20,22)
InChIKeyBAVZFAJKPWGJAR-UHFFFAOYSA-N
XLogP1.65
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-morpholin-4-yl-N-propan-2-ylpyridine-3-sulfonamide
CID 58525227
2,4-dichloro-N-[[6-(4-phenylpiperazin-1-yl)-3-pyridinyl]sulfonyl]benzamide
CID 24956235
N-(5-methyl-2-pyridinyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 18142509
[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid
CID 174214991
2,4-dimethyl-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]benzamide
CID 38528042
2,4-dimethyl-N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]benzamide
CID 91966839
N-[[6-(azepan-1-yl)-3-pyridinyl]sulfonyl]-4-chloro-2-(trifluoromethyl)benzamide
CID 24998166
2,4-dimethyl-N-[2-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]benzamide
CID 56700339
N-benzyl-6-morpholin-4-ylpyridine-3-sulfonamide
CID 154844946
N-(3,4-dimethylphenyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 17424831
3-(2,4-dimethylphenyl)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 16613280
methyl 4-[(6-morpholin-4-yl-3-pyridinyl)methylsulfamoyl]benzoate
CID 25469683

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide?
The IUPAC name of 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide (CID 24997264) is 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide.
What is the SMILES notation for 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide?
The canonical SMILES for 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide is Cc1ccc(C(=O)NS(=O)(=O)c2ccc(N3CCOCC3)nc2)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide?
The InChIKey is BAVZFAJKPWGJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4S/c1-13-3-5-16(14(2)11-13)18(22)20-26(23,24)15-4-6-17(19-12-15)21-7-9-25-10-8-21/h3-6,11-12H,7-10H2,1-2H3,(H,20,22).
What are the key properties of 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide?
2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide has a molecular weight of 375.45 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]benzamide is sourced from PubChem (CID 24997264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).