methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate

C18H20N2O5S — CID 66666905

IUPACmethyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate
SMILESCOCCN(C)S(=O)(=O)c1ccc2c(C(=O)OC)c3ccccn3c2c1
InChIInChI=1S/C18H20N2O5S/c1-19(10-11-24-2)26(22,23)13-7-8-14-16(12-13)20-9-5-4-6-15(20)17(14)18(21)25-3/h4-9,12H,10-11H2,1-3H3
InChIKeyKMOACGQBNJDABD-UHFFFAOYSA-N
MW376.43 g/mol
LogP2.15
Rot. Bonds6

About methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate

methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate (PubChem CID 66666905) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate.

Molecular Properties

Compound Namemethyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate
PubChem CID66666905
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC Namemethyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate
SMILESCOCCN(C)S(=O)(=O)c1ccc2c(C(=O)OC)c3ccccn3c2c1
InChIInChI=1S/C18H20N2O5S/c1-19(10-11-24-2)26(22,23)13-7-8-14-16(12-13)20-9-5-4-6-15(20)17(14)18(21)25-3/h4-9,12H,10-11H2,1-3H3
InChIKeyKMOACGQBNJDABD-UHFFFAOYSA-N
XLogP2.15
TPSA77.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate with MolForge

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Related Compounds

methyl 3-[2-(dimethylamino)-1-hydroxyethyl]pyrido[1,2-a]indole-10-carboxylate
CID 66667553
methyl 3-[4-amino-1-(dimethylamino)-4-oxobutan-2-yl]oxypyrido[1,2-a]indole-10-carboxylate
CID 56644027
methyl 7-(2-methoxyethylsulfonyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667770
2-(dimethylamino)ethyl 3-(4-methoxybutanoyl)pyrido[1,2-a]indole-10-carboxylate
CID 66667334
3-N,10-N-bis[2-(dimethylamino)ethyl]pyrido[1,2-a]indole-3,10-dicarboxamide
CID 66667040
methyl 3-(1-cyanoethoxy)pyrido[1,2-a]indole-10-carboxylate
CID 66667840
2-(dimethylamino)ethyl 3-(dimethylcarbamothioyl)pyrido[1,2-a]indole-10-carboxylate
CID 87097174
3-methoxypyrido[1,2-a]indole-10-carboxamide
CID 56645534
ethyl 2-ethoxy-5-[2-methoxyethyl(methyl)sulfamoyl]benzoate
CID 69465529
3-bromo-4-chloro-N-(2-methoxyethyl)-N-methylbenzenesulfonamide
CID 106545645
3-N-methylpyrido[1,2-a]indole-3,10-dicarboxamide
CID 66667151
2-chloro-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridine-3-sulfonamide
CID 47298945

Frequently Asked Questions

What is the IUPAC name of methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate?
The IUPAC name of methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate (CID 66666905) is methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate.
What is the SMILES notation for methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate?
The canonical SMILES for methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate is COCCN(C)S(=O)(=O)c1ccc2c(C(=O)OC)c3ccccn3c2c1.
What is the InChIKey of methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate?
The InChIKey is KMOACGQBNJDABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-19(10-11-24-2)26(22,23)13-7-8-14-16(12-13)20-9-5-4-6-15(20)17(14)18(21)25-3/h4-9,12H,10-11H2,1-3H3.
What are the key properties of methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate?
methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate has a molecular weight of 376.43 g/mol, XLogP of 2.15, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-[2-methoxyethyl(methyl)sulfamoyl]pyrido[1,2-a]indole-10-carboxylate is sourced from PubChem (CID 66666905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).