2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline

C9H15N3O3S — CID 107466334

IUPAC2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline
SMILESCNS(=O)(=O)Nc1c(CN)cccc1OC
InChIInChI=1S/C9H15N3O3S/c1-11-16(13,14)12-9-7(6-10)4-3-5-8(9)15-2/h3-5,11-12H,6,10H2,1-2H3
InChIKeyVHFQQYVZKNJOIY-UHFFFAOYSA-N
MW245.30 g/mol
LogP0.03
Rot. Bonds5

About 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline

2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline (PubChem CID 107466334) has the molecular formula C9H15N3O3S and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline.

Molecular Properties

Compound Name2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline
PubChem CID107466334
Molecular FormulaC9H15N3O3S
Molecular Weight245.30 g/mol
Exact Mass245.08
IUPAC Name2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline
SMILESCNS(=O)(=O)Nc1c(CN)cccc1OC
InChIInChI=1S/C9H15N3O3S/c1-11-16(13,14)12-9-7(6-10)4-3-5-8(9)15-2/h3-5,11-12H,6,10H2,1-2H3
InChIKeyVHFQQYVZKNJOIY-UHFFFAOYSA-N
XLogP0.03
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)-6-methoxyphenyl]-2-ethoxyethanesulfonamide
CID 107466325
N-[2-(aminomethyl)-6-methoxyphenyl]-2-methylpyrazole-3-sulfonamide
CID 107466320
1-[2-(aminomethyl)-6-methoxyphenyl]-3-phenylurea
CID 107467314
(2-ethyl-6-methoxyphenyl)hydrazine
CID 130939442
(5-methoxynaphthalen-1-yl)methanamine
CID 59401298
N-[2-(aminomethyl)-6-methoxyphenyl]azepane-1-carboxamide
CID 107467309
1-methoxy-2-[(sulfamoylamino)methyl]benzene
CID 21041220
1,2-dimethoxy-3-[2-(sulfamoylamino)ethyl]benzene
CID 71659103
4-(aminomethyl)-N-(methylsulfamoyl)aniline
CID 112704468
2-(3-methoxy-2-methylsulfonylphenyl)ethanamine
CID 117330971
3-[2-(aminomethyl)-6-methoxyphenoxy]-N-methylpropanamide
CID 55061826
(2-acetamido-3-methoxyphenyl)methanesulfonyl chloride
CID 117445145

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline?
The IUPAC name of 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline (CID 107466334) is 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline.
What is the SMILES notation for 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline?
The canonical SMILES for 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline is CNS(=O)(=O)Nc1c(CN)cccc1OC.
What is the InChIKey of 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline?
The InChIKey is VHFQQYVZKNJOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3S/c1-11-16(13,14)12-9-7(6-10)4-3-5-8(9)15-2/h3-5,11-12H,6,10H2,1-2H3.
What are the key properties of 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline?
2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline has a molecular weight of 245.30 g/mol, XLogP of 0.03, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-6-methoxy-N-(methylsulfamoyl)aniline is sourced from PubChem (CID 107466334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).