N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine

C7H18N2O4S — CID 114814915

IUPACN-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine
SMILESCOCCONS(=O)(=O)NCC(C)C
InChIInChI=1S/C7H18N2O4S/c1-7(2)6-8-14(10,11)9-13-5-4-12-3/h7-9H,4-6H2,1-3H3
InChIKeyCGFYESNYPYLDTR-UHFFFAOYSA-N
MW226.30 g/mol
LogP-0.36
Rot. Bonds8

About N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine

N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine (PubChem CID 114814915) has the molecular formula C7H18N2O4S and a molecular weight of 226.30 g/mol. Its IUPAC name is N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine
PubChem CID114814915
Molecular FormulaC7H18N2O4S
Molecular Weight226.30 g/mol
Exact Mass226.10
IUPAC NameN-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine
SMILESCOCCONS(=O)(=O)NCC(C)C
InChIInChI=1S/C7H18N2O4S/c1-7(2)6-8-14(10,11)9-13-5-4-12-3/h7-9H,4-6H2,1-3H3
InChIKeyCGFYESNYPYLDTR-UHFFFAOYSA-N
XLogP-0.36
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(ethoxysulfamoyl)-2-methylpropan-1-amine
CID 114814909
2-methoxy-N-(2-methylpropoxysulfamoyl)ethanamine
CID 114814912
N-(2-methoxyethoxy)ethanesulfonamide
CID 82714483
3-methoxy-2-(2-methylpropylsulfamoylamino)propan-1-ol
CID 106184934
2-(2-methoxyethoxysulfamoyl)propanoic acid
CID 82706100
N-(2-methoxyethoxy)-3-methylbutan-1-amine
CID 82711034
methyl 2-(2-methylpropylsulfamoyl)acetate
CID 63928470
N-(2-methylpropylsulfamoyl)butan-2-amine
CID 114814896
N-(tert-butylsulfamoyl)-2-methylpropan-1-amine
CID 104538392
4-(2-methoxyethylsulfamoylamino)-3-methylbutanoic acid
CID 114814766
1-N-methyl-4-N-(2-methylpropylsulfamoyl)cyclohexane-1,4-diamine
CID 114814968
N-(2-methylpropoxysulfamoyl)propan-1-amine
CID 114807196

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine?
The IUPAC name of N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine (CID 114814915) is N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine.
What is the SMILES notation for N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine?
The canonical SMILES for N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine is COCCONS(=O)(=O)NCC(C)C.
What is the InChIKey of N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine?
The InChIKey is CGFYESNYPYLDTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O4S/c1-7(2)6-8-14(10,11)9-13-5-4-12-3/h7-9H,4-6H2,1-3H3.
What are the key properties of N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine?
N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine has a molecular weight of 226.30 g/mol, XLogP of -0.36, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethoxysulfamoyl)-2-methylpropan-1-amine is sourced from PubChem (CID 114814915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).