N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride

C10H24ClN3O4S — CID 119405243

IUPACN-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride
SMILESCC(C)OCCS(=O)(=O)NCC(=O)NCCCN.Cl
InChIInChI=1S/C10H23N3O4S.ClH/c1-9(2)17-6-7-18(15,16)13-8-10(14)12-5-3-4-11;/h9,13H,3-8,11H2,1-2H3,(H,12,14);1H
InChIKeyBBTYDOVWTRNHQS-UHFFFAOYSA-N
MW317.84 g/mol
LogP-0.78
Rot. Bonds10

About N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride

N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride (PubChem CID 119405243) has the molecular formula C10H24ClN3O4S and a molecular weight of 317.84 g/mol. Its IUPAC name is N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride
PubChem CID119405243
Molecular FormulaC10H24ClN3O4S
Molecular Weight317.84 g/mol
Exact Mass317.12
IUPAC NameN-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride
SMILESCC(C)OCCS(=O)(=O)NCC(=O)NCCCN.Cl
InChIInChI=1S/C10H23N3O4S.ClH/c1-9(2)17-6-7-18(15,16)13-8-10(14)12-5-3-4-11;/h9,13H,3-8,11H2,1-2H3,(H,12,14);1H
InChIKeyBBTYDOVWTRNHQS-UHFFFAOYSA-N
XLogP-0.78
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.84
LogP ≤ 5-0.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride 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-(2-amino-2-phenylethyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride
CID 119527625
(2S)-2-[[2-(2-propan-2-yloxyethylsulfonylamino)acetyl]amino]propanoic acid
CID 119238322
N-(2-amino-2-phenylethyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
CID 119527626
N-(3-aminobutyl)-2-propan-2-yloxyethanesulfonamide
CID 79593799
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide
CID 119572623
N'-hydroxy-2-(2-propan-2-yloxyethylsulfonylamino)ethanimidamide
CID 79594323
4-(2-propan-2-yloxyethylsulfonylamino)butanoic acid
CID 79593674
7-amino-N-(3-propan-2-yloxypropyl)heptanamide
CID 61275030
N-(2-chloroprop-2-enyl)-2-propan-2-yloxyethanesulfonamide
CID 115674519
5-(2-propan-2-yloxyethylsulfonylamino)pentanoic acid
CID 79594453
N-(6-amino-3-pyridinyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride
CID 119515101
N-(4-aminobutyl)-2-propan-2-yloxyacetamide
CID 112601737

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride?
The IUPAC name of N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride (CID 119405243) is N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride?
The canonical SMILES for N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride is CC(C)OCCS(=O)(=O)NCC(=O)NCCCN.Cl.
What is the InChIKey of N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride?
The InChIKey is BBTYDOVWTRNHQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O4S.ClH/c1-9(2)17-6-7-18(15,16)13-8-10(14)12-5-3-4-11;/h9,13H,3-8,11H2,1-2H3,(H,12,14);1H.
What are the key properties of N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride?
N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride has a molecular weight of 317.84 g/mol, XLogP of -0.78, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2-(2-propan-2-yloxyethylsulfonylamino)acetamide;hydrochloride is sourced from PubChem (CID 119405243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).