7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide

C11H25N3O3S — CID 113266677

IUPAC7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide
SMILESCCNS(=O)(=O)CCNC(=O)CCCCCCN
InChIInChI=1S/C11H25N3O3S/c1-2-14-18(16,17)10-9-13-11(15)7-5-3-4-6-8-12/h14H,2-10,12H2,1H3,(H,13,15)
InChIKeyVTYAESNMCJEQSZ-UHFFFAOYSA-N
MW279.41 g/mol
LogP-0.05
Rot. Bonds11

About 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide

7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide (PubChem CID 113266677) has the molecular formula C11H25N3O3S and a molecular weight of 279.41 g/mol. Its IUPAC name is 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide.

Molecular Properties

Compound Name7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide
PubChem CID113266677
Molecular FormulaC11H25N3O3S
Molecular Weight279.41 g/mol
Exact Mass279.16
IUPAC Name7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide
SMILESCCNS(=O)(=O)CCNC(=O)CCCCCCN
InChIInChI=1S/C11H25N3O3S/c1-2-14-18(16,17)10-9-13-11(15)7-5-3-4-6-8-12/h14H,2-10,12H2,1H3,(H,13,15)
InChIKeyVTYAESNMCJEQSZ-UHFFFAOYSA-N
XLogP-0.05
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-[2-(ethylsulfamoyl)ethylamino]-6-oxohexanoic acid
CID 114174957
6-amino-4-ethyl-N-[2-(ethylsulfamoyl)ethyl]hexanamide
CID 106337136
5-amino-N-[5-(propanoylamino)pentyl]pentanamide
CID 170966361
7-amino-N-(3-methylsulfonylpropyl)heptanamide
CID 54904867
4-amino-N-[2-(ethylsulfamoyl)ethyl]butane-1-sulfonamide
CID 106335894
6-amino-N-butylhexanamide
CID 14914743
7-amino-N-butylheptanamide
CID 24689519
N-[2-(ethylsulfamoyl)ethyl]-4-hydroxypentanamide
CID 106342894
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
2-bromo-N-[2-(ethylsulfamoyl)ethyl]acetamide
CID 106335462
N-(6-aminohexyl)dodecanamide
CID 13030555

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide?
The IUPAC name of 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide (CID 113266677) is 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide.
What is the SMILES notation for 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide?
The canonical SMILES for 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide is CCNS(=O)(=O)CCNC(=O)CCCCCCN.
What is the InChIKey of 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide?
The InChIKey is VTYAESNMCJEQSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O3S/c1-2-14-18(16,17)10-9-13-11(15)7-5-3-4-6-8-12/h14H,2-10,12H2,1H3,(H,13,15).
What are the key properties of 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide?
7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide has a molecular weight of 279.41 g/mol, XLogP of -0.05, 11 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide is sourced from PubChem (CID 113266677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).