4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide

C19H23N3O4S — CID 5193187

IUPAC4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide
SMILESCc1cccnc1NC(=O)c1ccc(S(=O)(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C19H23N3O4S/c1-13-5-4-10-20-18(13)21-19(23)16-6-8-17(9-7-16)27(24,25)22-11-14(2)26-15(3)12-22/h4-10,14-15H,11-12H2,1-3H3,(H,20,21,23)
InChIKeyOLNKHJPTWJMKST-UHFFFAOYSA-N
MW389.48 g/mol
LogP2.44
Rot. Bonds4

About 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide

4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide (PubChem CID 5193187) has the molecular formula C19H23N3O4S and a molecular weight of 389.48 g/mol. Its IUPAC name is 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide
PubChem CID5193187
Molecular FormulaC19H23N3O4S
Molecular Weight389.48 g/mol
Exact Mass389.14
IUPAC Name4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide
SMILESCc1cccnc1NC(=O)c1ccc(S(=O)(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C19H23N3O4S/c1-13-5-4-10-20-18(13)21-19(23)16-6-8-17(9-7-16)27(24,25)22-11-14(2)26-15(3)12-22/h4-10,14-15H,11-12H2,1-3H3,(H,20,21,23)
InChIKeyOLNKHJPTWJMKST-UHFFFAOYSA-N
XLogP2.44
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.48
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-Chloro-pyridin-2-yl)-3-(piperidine-1-sulfonyl)-benzamide
CID 1124159
N-(6-methylpyridin-2-yl)-4-(morpholinosulfonyl)benzamide
CID 1356345
3-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide
CID 3712018
3-[ethyl(phenyl)sulfamoyl]-N-(5-methylpyridin-2-yl)benzamide
CID 24816731
5-(tert-butylsulfamoyl)-2-methyl-N-(5-methylpyridin-2-yl)benzamide
CID 16354321
{4-[(dipropylamino)sulfonyl]phenyl}-N-(2-pyridyl)carboxamide
CID 17385730
N-(5-Chloro-pyridin-2-yl)-3-diethylsulfamoyl-benzamide
CID 652548
4-(1-piperidinylsulfonyl)-N-(2-pyridinyl)benzamide
CID 862032
3-[(diethylamino)sulfonyl]-4-methyl-N-2-pyridinylbenzamide
CID 871491
2-[[4-(dimethylsulfamoyl)benzoyl]amino]-N-pyridin-2-ylbenzamide
CID 990951
N-(4-methylpyridin-2-yl)-3-morpholin-4-ylsulfonylbenzamide
CID 1087730
3-{[(2-methylphenyl)sulfonyl]amino}-N-(4-methyl-2-pyridinyl)benzamide
CID 1228486

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide?
The IUPAC name of 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide (CID 5193187) is 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide is Cc1cccnc1NC(=O)c1ccc(S(=O)(=O)N2CC(C)OC(C)C2)cc1.
What is the InChIKey of 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide?
The InChIKey is OLNKHJPTWJMKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S/c1-13-5-4-10-20-18(13)21-19(23)16-6-8-17(9-7-16)27(24,25)22-11-14(2)26-15(3)12-22/h4-10,14-15H,11-12H2,1-3H3,(H,20,21,23).
What are the key properties of 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide?
4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide has a molecular weight of 389.48 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(3-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 5193187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).