2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine

C8H14N4O3S — CID 114814034

IUPAC2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine
SMILESCOCCNS(=O)(=O)Nc1ccc(N)cn1
InChIInChI=1S/C8H14N4O3S/c1-15-5-4-11-16(13,14)12-8-3-2-7(9)6-10-8/h2-3,6,11H,4-5,9H2,1H3,(H,10,12)
InChIKeyVZLSZJPZIKDLSN-UHFFFAOYSA-N
MW246.29 g/mol
LogP-0.44
Rot. Bonds6

About 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine

2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine (PubChem CID 114814034) has the molecular formula C8H14N4O3S and a molecular weight of 246.29 g/mol. Its IUPAC name is 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine
PubChem CID114814034
Molecular FormulaC8H14N4O3S
Molecular Weight246.29 g/mol
Exact Mass246.08
IUPAC Name2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine
SMILESCOCCNS(=O)(=O)Nc1ccc(N)cn1
InChIInChI=1S/C8H14N4O3S/c1-15-5-4-11-16(13,14)12-8-3-2-7(9)6-10-8/h2-3,6,11H,4-5,9H2,1H3,(H,10,12)
InChIKeyVZLSZJPZIKDLSN-UHFFFAOYSA-N
XLogP-0.44
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethyl N-[(5-amino-2-pyridinyl)sulfamoyl]carbamate
CID 114461535
4-amino-2-(2-methoxyethylsulfamoylamino)benzoic acid
CID 114814171
N-(5-amino-2-pyridinyl)-4-methoxybenzenesulfonamide
CID 43327268
N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide
CID 113025091
2-methoxy-4-N-(2-methoxyethylsulfamoyl)benzene-1,4-diamine
CID 114815986
2-(2-methoxyethylsulfamoylamino)pyridin-3-ol
CID 114815576
4-bromo-1-N-(2-methoxyethylsulfamoyl)benzene-1,3-diamine
CID 114814198
6-(ethylamino)-N-(2-methoxyethyl)pyridine-3-sulfonamide
CID 62148459
N-(2-methoxyethylsulfamoyl)-1H-1,2,4-triazol-5-amine
CID 114815885
2-amino-N-(2-methoxyethyl)-1,3-thiazole-5-sulfonamide
CID 91812348
5-(2-methoxyethylsulfamoylamino)-1H-pyrazole-4-carbonitrile
CID 114815166
2-(2-methoxyethylsulfamoylamino)benzenecarbothioamide
CID 114815185

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine?
The IUPAC name of 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine (CID 114814034) is 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine.
What is the SMILES notation for 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine?
The canonical SMILES for 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine is COCCNS(=O)(=O)Nc1ccc(N)cn1.
What is the InChIKey of 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine?
The InChIKey is VZLSZJPZIKDLSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O3S/c1-15-5-4-11-16(13,14)12-8-3-2-7(9)6-10-8/h2-3,6,11H,4-5,9H2,1H3,(H,10,12).
What are the key properties of 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine?
2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine has a molecular weight of 246.29 g/mol, XLogP of -0.44, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methoxyethylsulfamoyl)pyridine-2,5-diamine is sourced from PubChem (CID 114814034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).