ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate

C14H20N2O6S — CID 9472159

IUPACethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate
SMILESCCOC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1OC
InChIInChI=1S/C14H20N2O6S/c1-3-22-14(17)15-12-10-11(4-5-13(12)20-2)23(18,19)16-6-8-21-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyAXPZHXPTQUOPDP-UHFFFAOYSA-N
MW344.39 g/mol
LogP1.28
Rot. Bonds5

About ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate

ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate (PubChem CID 9472159) has the molecular formula C14H20N2O6S and a molecular weight of 344.39 g/mol. Its IUPAC name is ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate.

Molecular Properties

Compound Nameethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate
PubChem CID9472159
Molecular FormulaC14H20N2O6S
Molecular Weight344.39 g/mol
Exact Mass344.10
IUPAC Nameethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate
SMILESCCOC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1OC
InChIInChI=1S/C14H20N2O6S/c1-3-22-14(17)15-12-10-11(4-5-13(12)20-2)23(18,19)16-6-8-21-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyAXPZHXPTQUOPDP-UHFFFAOYSA-N
XLogP1.28
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbamate
CID 9081620
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylsulfanylacetamide
CID 8746733
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylpropanamide
CID 8746778
(2R)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylpentanamide
CID 8746910
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-sulfamoylbenzamide
CID 24636022
ethyl 6-[(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamoyl]-2-methylpyridine-3-carboxylate
CID 55600393
2-(azepan-1-yl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
CID 4965549
4-(ethylsulfamoyl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)benzamide
CID 24636024
4-(4-ethoxyphenoxy)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)butanamide
CID 4688141
[2-(2-methoxy-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl] (E)-pent-2-enoate
CID 8673318
(2R)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(3-methylphenoxy)butanamide
CID 94016517
ethyl 4-(3-acetamido-4-methoxyphenyl)sulfonylpiperazine-1-carboxylate
CID 8777810

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate?
The IUPAC name of ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate (CID 9472159) is ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate.
What is the SMILES notation for ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate?
The canonical SMILES for ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate is CCOC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1OC.
What is the InChIKey of ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate?
The InChIKey is AXPZHXPTQUOPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O6S/c1-3-22-14(17)15-12-10-11(4-5-13(12)20-2)23(18,19)16-6-8-21-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17).
What are the key properties of ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate?
ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate has a molecular weight of 344.39 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)carbamate is sourced from PubChem (CID 9472159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).