2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide

C11H25N3O3S — CID 103840332

IUPAC2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide
SMILESCCNS(=O)(=O)CCNC(=O)C(CC)(CC)CN
InChIInChI=1S/C11H25N3O3S/c1-4-11(5-2,9-12)10(15)13-7-8-18(16,17)14-6-3/h14H,4-9,12H2,1-3H3,(H,13,15)
InChIKeyAJGVCLHEPPKLSL-UHFFFAOYSA-N
MW279.41 g/mol
LogP-0.19
Rot. Bonds9

About 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide

2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide (PubChem CID 103840332) has the molecular formula C11H25N3O3S and a molecular weight of 279.41 g/mol. Its IUPAC name is 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide.

Molecular Properties

Compound Name2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide
PubChem CID103840332
Molecular FormulaC11H25N3O3S
Molecular Weight279.41 g/mol
Exact Mass279.16
IUPAC Name2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide
SMILESCCNS(=O)(=O)CCNC(=O)C(CC)(CC)CN
InChIInChI=1S/C11H25N3O3S/c1-4-11(5-2,9-12)10(15)13-7-8-18(16,17)14-6-3/h14H,4-9,12H2,1-3H3,(H,13,15)
InChIKeyAJGVCLHEPPKLSL-UHFFFAOYSA-N
XLogP-0.19
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 5-0.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyano-N-[2-(ethylsulfamoyl)ethyl]-2-methylbutanamide
CID 114175317
2-amino-N-[2-(ethylsulfamoyl)ethyl]propanamide
CID 103796449
2-bromo-N-[2-(ethylsulfamoyl)ethyl]acetamide
CID 106335462
7-amino-N-[2-(ethylsulfamoyl)ethyl]heptanamide
CID 113266677
4-[2-(ethylsulfamoyl)ethylamino]-2,2-dimethyl-4-oxobutanoic acid
CID 106334761
2-methyl-2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]propanamide
CID 106336691
2-[4-(aminomethyl)phenyl]-N-[2-(ethylsulfamoyl)ethyl]acetamide
CID 106333121
(2S)-2-amino-N-[2-(ethylsulfamoyl)ethyl]-3-methylpentanamide
CID 103833076
N-[2-(ethylsulfamoyl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103944363
2-amino-N-[2-(ethylsulfamoyl)ethyl]hexanamide
CID 103832741
N-[2-(ethylsulfamoyl)ethyl]-3-methyl-2-sulfanylbutanamide
CID 106340115
2-(aminomethyl)-2-ethyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104759851

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide?
The IUPAC name of 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide (CID 103840332) is 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide.
What is the SMILES notation for 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide?
The canonical SMILES for 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide is CCNS(=O)(=O)CCNC(=O)C(CC)(CC)CN.
What is the InChIKey of 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide?
The InChIKey is AJGVCLHEPPKLSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O3S/c1-4-11(5-2,9-12)10(15)13-7-8-18(16,17)14-6-3/h14H,4-9,12H2,1-3H3,(H,13,15).
What are the key properties of 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide?
2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide has a molecular weight of 279.41 g/mol, XLogP of -0.19, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-2-ethyl-N-[2-(ethylsulfamoyl)ethyl]butanamide is sourced from PubChem (CID 103840332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).