4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide

C11H17N3O3S — CID 43711207

IUPAC4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide
SMILESNCCCC(=O)Nc1ccc(CS(N)(=O)=O)cc1
InChIInChI=1S/C11H17N3O3S/c12-7-1-2-11(15)14-10-5-3-9(4-6-10)8-18(13,16)17/h3-6H,1-2,7-8,12H2,(H,14,15)(H2,13,16,17)
InChIKeyJDQNYILBVCSJPK-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.15
Rot. Bonds6

About 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide

4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide (PubChem CID 43711207) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide.

Molecular Properties

Compound Name4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide
PubChem CID43711207
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide
SMILESNCCCC(=O)Nc1ccc(CS(N)(=O)=O)cc1
InChIInChI=1S/C11H17N3O3S/c12-7-1-2-11(15)14-10-5-3-9(4-6-10)8-18(13,16)17/h3-6H,1-2,7-8,12H2,(H,14,15)(H2,13,16,17)
InChIKeyJDQNYILBVCSJPK-UHFFFAOYSA-N
XLogP0.15
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(4-aminophenyl)butanamide
CID 90105668
4-amino-N-[4-(carbamoylamino)phenyl]butanamide
CID 43711123
4-amino-N-(4-ethylsulfonylphenyl)butanamide
CID 43704501
4-amino-N-(4-pentylphenyl)butanamide
CID 61248586
4-amino-N-[4-(propanoylamino)phenyl]butanamide;hydrochloride
CID 119296184
3-(2,2-difluoroethoxy)-N-[4-(sulfamoylmethyl)phenyl]propanamide
CID 103211679
3-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide;hydrochloride
CID 119701893
4-amino-N-[4-(methylcarbamoylamino)phenyl]butanamide
CID 43710929
N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 55548784
7-amino-N-(4-bromophenyl)heptanamide;hydrochloride
CID 119670334
2-(1-hydroxycyclohexyl)-N-[4-(sulfamoylmethyl)phenyl]acetamide
CID 138042895
6-amino-N-[4-(carbamoylamino)phenyl]hexanamide
CID 43711108

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide?
The IUPAC name of 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide (CID 43711207) is 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide.
What is the SMILES notation for 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide?
The canonical SMILES for 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide is NCCCC(=O)Nc1ccc(CS(N)(=O)=O)cc1.
What is the InChIKey of 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide?
The InChIKey is JDQNYILBVCSJPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c12-7-1-2-11(15)14-10-5-3-9(4-6-10)8-18(13,16)17/h3-6H,1-2,7-8,12H2,(H,14,15)(H2,13,16,17).
What are the key properties of 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide?
4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide has a molecular weight of 271.34 g/mol, XLogP of 0.15, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(sulfamoylmethyl)phenyl]butanamide is sourced from PubChem (CID 43711207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).