2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide

C11H22N2O3S — CID 113268578

IUPAC2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide
SMILESCC(C)(C)S(=O)(=O)CCNCC(=O)NC1CC1
InChIInChI=1S/C11H22N2O3S/c1-11(2,3)17(15,16)7-6-12-8-10(14)13-9-4-5-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyJZANPRQSHHPABC-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.07
Rot. Bonds6

About 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide

2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide (PubChem CID 113268578) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide
PubChem CID113268578
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC Name2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide
SMILESCC(C)(C)S(=O)(=O)CCNCC(=O)NC1CC1
InChIInChI=1S/C11H22N2O3S/c1-11(2,3)17(15,16)7-6-12-8-10(14)13-9-4-5-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyJZANPRQSHHPABC-UHFFFAOYSA-N
XLogP0.07
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-2-(2-methylsulfonylethylamino)acetamide
CID 60915783
N-cyclopropyl-2-(2,2-dimethylpropylamino)acetamide
CID 61167227
N-cyclopropyl-2-(3-hydroxybutylamino)acetamide
CID 64912481
2-(2-tert-butylsulfonylethylamino)-N,N-dimethylacetamide
CID 106723195
N-(4-methylcyclohexyl)-2-(propylamino)acetamide
CID 60671942
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]propanoic acid
CID 43466674
N-cyclopropyl-2-(2,2-dimethylbutylamino)acetamide
CID 103698505
N-cyclopentyl-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
CID 79552375
4-[[2-(cyclopropylamino)-2-oxoethyl]amino]butanoic acid
CID 43473310
2-(3-aminopropylamino)-N-cyclopropylacetamide
CID 62274184
N-cyclopropyl-2-[[2-(dimethylamino)-2-methylpropyl]amino]acetamide
CID 60693773
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-ethylpropanamide
CID 62325687

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide?
The IUPAC name of 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide (CID 113268578) is 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide?
The canonical SMILES for 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide is CC(C)(C)S(=O)(=O)CCNCC(=O)NC1CC1.
What is the InChIKey of 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide?
The InChIKey is JZANPRQSHHPABC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-11(2,3)17(15,16)7-6-12-8-10(14)13-9-4-5-9/h9,12H,4-8H2,1-3H3,(H,13,14).
What are the key properties of 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide?
2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide has a molecular weight of 262.37 g/mol, XLogP of 0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butylsulfonylethylamino)-N-cyclopropylacetamide is sourced from PubChem (CID 113268578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).