1,2-diethoxy-4-(sulfamoylamino)benzene

C10H16N2O4S — CID 112573189

IUPAC1,2-diethoxy-4-(sulfamoylamino)benzene
SMILESCCOc1ccc(NS(N)(=O)=O)cc1OCC
InChIInChI=1S/C10H16N2O4S/c1-3-15-9-6-5-8(12-17(11,13)14)7-10(9)16-4-2/h5-7,12H,3-4H2,1-2H3,(H2,11,13,14)
InChIKeyJXTDZDAXYDTXMM-UHFFFAOYSA-N
MW260.31 g/mol
LogP1.10
Rot. Bonds6

About 1,2-diethoxy-4-(sulfamoylamino)benzene

1,2-diethoxy-4-(sulfamoylamino)benzene (PubChem CID 112573189) has the molecular formula C10H16N2O4S and a molecular weight of 260.31 g/mol. Its IUPAC name is 1,2-diethoxy-4-(sulfamoylamino)benzene.

Molecular Properties

Compound Name1,2-diethoxy-4-(sulfamoylamino)benzene
PubChem CID112573189
Molecular FormulaC10H16N2O4S
Molecular Weight260.31 g/mol
Exact Mass260.08
IUPAC Name1,2-diethoxy-4-(sulfamoylamino)benzene
SMILESCCOc1ccc(NS(N)(=O)=O)cc1OCC
InChIInChI=1S/C10H16N2O4S/c1-3-15-9-6-5-8(12-17(11,13)14)7-10(9)16-4-2/h5-7,12H,3-4H2,1-2H3,(H2,11,13,14)
InChIKeyJXTDZDAXYDTXMM-UHFFFAOYSA-N
XLogP1.10
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dichloro-N-(3,4-diethoxyphenyl)benzenesulfonamide
CID 8851611
3,4-diethoxy-N-(4-sulfamoylphenyl)benzenesulfonamide
CID 27658093
N-(4-ethoxy-3-methoxyphenyl)propane-2-sulfonamide
CID 62997998
N-(3,4-diethoxyphenyl)acetamide
CID 13120229
2-chloro-N-(4-ethoxy-3-methoxyphenyl)ethanesulfonamide
CID 107650750
3,4-diethoxy-N-(4-methylsulfonylphenyl)benzenesulfonamide
CID 9056028
3,4-diethoxy-N-(3-methylsulfonylpropyl)aniline
CID 63191159
3,4-diethoxy-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 55551961
N-(3-chloro-4-ethoxyphenyl)propane-1-sulfonamide
CID 61062480
N'-(3,4-diethoxyphenyl)propane-1,3-diamine
CID 62505868
N-(3,4-diethoxyphenyl)-2-methoxy-5-nitrobenzenesulfonamide
CID 8823324
2-ethoxy-1-methoxy-4-[[2-methoxyethyl(methyl)sulfamoyl]amino]benzene
CID 166240379

Frequently Asked Questions

What is the IUPAC name of 1,2-diethoxy-4-(sulfamoylamino)benzene?
The IUPAC name of 1,2-diethoxy-4-(sulfamoylamino)benzene (CID 112573189) is 1,2-diethoxy-4-(sulfamoylamino)benzene.
What is the SMILES notation for 1,2-diethoxy-4-(sulfamoylamino)benzene?
The canonical SMILES for 1,2-diethoxy-4-(sulfamoylamino)benzene is CCOc1ccc(NS(N)(=O)=O)cc1OCC.
What is the InChIKey of 1,2-diethoxy-4-(sulfamoylamino)benzene?
The InChIKey is JXTDZDAXYDTXMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4S/c1-3-15-9-6-5-8(12-17(11,13)14)7-10(9)16-4-2/h5-7,12H,3-4H2,1-2H3,(H2,11,13,14).
What are the key properties of 1,2-diethoxy-4-(sulfamoylamino)benzene?
1,2-diethoxy-4-(sulfamoylamino)benzene has a molecular weight of 260.31 g/mol, XLogP of 1.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethoxy-4-(sulfamoylamino)benzene is sourced from PubChem (CID 112573189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).