4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide

C17H19N3O5S — CID 1330364

IUPAC4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2cccnc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C17H19N3O5S/c1-24-15-5-4-13(17(21)19-14-3-2-6-18-12-14)11-16(15)26(22,23)20-7-9-25-10-8-20/h2-6,11-12H,7-10H2,1H3,(H,19,21)
InChIKeyVVLZBGILRLDSAI-UHFFFAOYSA-N
MW377.42 g/mol
LogP1.36
Rot. Bonds5

About 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide

4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide (PubChem CID 1330364) has the molecular formula C17H19N3O5S and a molecular weight of 377.42 g/mol. Its IUPAC name is 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide
PubChem CID1330364
Molecular FormulaC17H19N3O5S
Molecular Weight377.42 g/mol
Exact Mass377.10
IUPAC Name4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2cccnc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C17H19N3O5S/c1-24-15-5-4-13(17(21)19-14-3-2-6-18-12-14)11-16(15)26(22,23)20-7-9-25-10-8-20/h2-6,11-12H,7-10H2,1H3,(H,19,21)
InChIKeyVVLZBGILRLDSAI-UHFFFAOYSA-N
XLogP1.36
TPSA97.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-Methoxy-N-[4-(3-methoxy-pyrazin-2-ylsulfamoyl)-phenyl]-benzamide
CID 1068859
N-(6-methoxy-3-pyridinyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 2334703
4-Methoxy-3-(pyridin-3-ylsulfamoyl)-benzoic acid methyl ester
CID 56684281
4-{[(4-methoxyphenyl)sulfonyl](methyl)amino}-N-(pyridin-3-yl)benzamide
CID 1242126
4-methoxy-3-(4-morpholinylsulfonyl)-N-(3-pyridinylmethyl)benzamide
CID 1309905
N-[2-(1H-indol-3-yl)ethyl]-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
CID 2109484
4-methoxy-N-methyl-3-[(4-methylphenyl)sulfamoyl]-N-(pyridin-3-ylmethyl)benzamide
CID 2486297
5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 2512107
3-[(4-bromophenyl)sulfamoyl]-4-methoxy-N-(2-pyridin-2-ylethyl)benzamide
CID 2535494
3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-4-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 2620960
N-{2-Methoxy-5-[(pyridin-4-ylmethyl)-sulfamoyl]-phenyl}-benzamide
CID 6458062
N-{2-Ethoxy-5-[(pyridin-2-ylmethyl)-sulfamoyl]-phenyl}-benzamide
CID 6459929

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide?
The IUPAC name of 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide (CID 1330364) is 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide?
The canonical SMILES for 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide is COc1ccc(C(=O)Nc2cccnc2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide?
The InChIKey is VVLZBGILRLDSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O5S/c1-24-15-5-4-13(17(21)19-14-3-2-6-18-12-14)11-16(15)26(22,23)20-7-9-25-10-8-20/h2-6,11-12H,7-10H2,1H3,(H,19,21).
What are the key properties of 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide?
4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide has a molecular weight of 377.42 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-morpholin-4-ylsulfonyl-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 1330364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).