4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine

C10H17N3O3S — CID 75416252

IUPAC4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine
SMILESCCOc1cc(CNS(=O)(=O)N(C)C)ccn1
InChIInChI=1S/C10H17N3O3S/c1-4-16-10-7-9(5-6-11-10)8-12-17(14,15)13(2)3/h5-7,12H,4,8H2,1-3H3
InChIKeyOCHPUJRFONTEBQ-UHFFFAOYSA-N
MW259.33 g/mol
LogP0.38
Rot. Bonds6

About 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine

4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine (PubChem CID 75416252) has the molecular formula C10H17N3O3S and a molecular weight of 259.33 g/mol. Its IUPAC name is 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine.

Molecular Properties

Compound Name4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine
PubChem CID75416252
Molecular FormulaC10H17N3O3S
Molecular Weight259.33 g/mol
Exact Mass259.10
IUPAC Name4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine
SMILESCCOc1cc(CNS(=O)(=O)N(C)C)ccn1
InChIInChI=1S/C10H17N3O3S/c1-4-16-10-7-9(5-6-11-10)8-12-17(14,15)13(2)3/h5-7,12H,4,8H2,1-3H3
InChIKeyOCHPUJRFONTEBQ-UHFFFAOYSA-N
XLogP0.38
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[[butyl(methyl)sulfamoyl]amino]methyl]-2-phenylmethoxypyridine
CID 47064895
4-[[[3-aminopropyl(methyl)sulfamoyl]amino]methyl]-2-methoxypyridine
CID 55142109
4-[(diethylsulfamoylamino)methyl]-2-(3,5-dimethylphenoxy)pyridine
CID 47064917
4-[(dipropylsulfamoylamino)methyl]-2-phenoxypyridine
CID 47064941
2-methoxy-4-[[[methyl-[3-(methylamino)propyl]sulfamoyl]amino]methyl]pyridine
CID 106062063
4-(2,2-dimethylpropylsulfonylmethyl)-2-ethoxypyridine
CID 167925497
2-(1,3-benzodioxol-5-ylmethoxy)-4-[[[butyl(methyl)sulfamoyl]amino]methyl]pyridine
CID 47065062
4-[[[2-methoxyethyl(methyl)sulfamoyl]amino]methyl]-2-(4-methylcyclohexyl)oxypyridine
CID 75464073
2-(2-ethoxy-4-pyridinyl)-N-methylethanamine
CID 83875505
1-[(dimethylsulfamoylamino)methyl]-3-methylbenzene
CID 35383494
5-[(dimethylsulfamoylamino)methyl]-2-methylpyridine
CID 47215825
1-[(dimethylsulfamoylamino)methyl]-3-hydroxybenzene
CID 61018712

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine?
The IUPAC name of 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine (CID 75416252) is 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine.
What is the SMILES notation for 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine?
The canonical SMILES for 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine is CCOc1cc(CNS(=O)(=O)N(C)C)ccn1.
What is the InChIKey of 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine?
The InChIKey is OCHPUJRFONTEBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S/c1-4-16-10-7-9(5-6-11-10)8-12-17(14,15)13(2)3/h5-7,12H,4,8H2,1-3H3.
What are the key properties of 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine?
4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine has a molecular weight of 259.33 g/mol, XLogP of 0.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylsulfamoylamino)methyl]-2-ethoxypyridine is sourced from PubChem (CID 75416252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).