2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide

C18H23N3O5S — CID 30149815

IUPAC2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide
SMILESCCS(=O)(=O)N(C)c1cc(OC)c(OC)cc1C(=O)NCc1ccccn1
InChIInChI=1S/C18H23N3O5S/c1-5-27(23,24)21(2)15-11-17(26-4)16(25-3)10-14(15)18(22)20-12-13-8-6-7-9-19-13/h6-11H,5,12H2,1-4H3,(H,20,22)
InChIKeyUHPJSFNKEAFHJS-UHFFFAOYSA-N
MW393.47 g/mol
LogP1.81
Rot. Bonds8

About 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide

2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 30149815) has the molecular formula C18H23N3O5S and a molecular weight of 393.47 g/mol. Its IUPAC name is 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide
PubChem CID30149815
Molecular FormulaC18H23N3O5S
Molecular Weight393.47 g/mol
Exact Mass393.14
IUPAC Name2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide
SMILESCCS(=O)(=O)N(C)c1cc(OC)c(OC)cc1C(=O)NCc1ccccn1
InChIInChI=1S/C18H23N3O5S/c1-5-27(23,24)21(2)15-11-17(26-4)16(25-3)10-14(15)18(22)20-12-13-8-6-7-9-19-13/h6-11H,5,12H2,1-4H3,(H,20,22)
InChIKeyUHPJSFNKEAFHJS-UHFFFAOYSA-N
XLogP1.81
TPSA97.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[benzyl(methylsulfonyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide
CID 30150724
N-butyl-2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxybenzamide
CID 30149679
2,5-dimethoxy-4-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 110763244
5-acetamido-2-methoxy-N-(pyridin-2-ylmethyl)benzamide
CID 110764476
2-[(4-ethoxyphenyl)sulfonylamino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide
CID 26549903
5-tert-butyl-2-methoxy-N-(pyridin-2-ylmethyl)benzamide
CID 110761323
5-chloro-2-methoxy-4-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 110762042
2-[benzenesulfonyl(methyl)amino]-N-(pyridin-2-ylmethyl)benzamide
CID 126346032
N-(3-chloro-2-methylphenyl)-2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxybenzamide
CID 30149936
5,6-dimethoxy-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide
CID 7678004
2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 43889355
2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 30150418

Frequently Asked Questions

What is the IUPAC name of 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide (CID 30149815) is 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide is CCS(=O)(=O)N(C)c1cc(OC)c(OC)cc1C(=O)NCc1ccccn1.
What is the InChIKey of 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is UHPJSFNKEAFHJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O5S/c1-5-27(23,24)21(2)15-11-17(26-4)16(25-3)10-14(15)18(22)20-12-13-8-6-7-9-19-13/h6-11H,5,12H2,1-4H3,(H,20,22).
What are the key properties of 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide?
2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 393.47 g/mol, XLogP of 1.81, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethylsulfonyl(methyl)amino]-4,5-dimethoxy-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 30149815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).