N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide

C10H24N2O3S — CID 79594690

IUPACN-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide
SMILESCCN(CCCN)S(=O)(=O)CCOC(C)C
InChIInChI=1S/C10H24N2O3S/c1-4-12(7-5-6-11)16(13,14)9-8-15-10(2)3/h10H,4-9,11H2,1-3H3
InChIKeyUVHVUZULGMNCFT-UHFFFAOYSA-N
MW252.38 g/mol
LogP0.41
Rot. Bonds9

About N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide

N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide (PubChem CID 79594690) has the molecular formula C10H24N2O3S and a molecular weight of 252.38 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide
PubChem CID79594690
Molecular FormulaC10H24N2O3S
Molecular Weight252.38 g/mol
Exact Mass252.15
IUPAC NameN-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide
SMILESCCN(CCCN)S(=O)(=O)CCOC(C)C
InChIInChI=1S/C10H24N2O3S/c1-4-12(7-5-6-11)16(13,14)9-8-15-10(2)3/h10H,4-9,11H2,1-3H3
InChIKeyUVHVUZULGMNCFT-UHFFFAOYSA-N
XLogP0.41
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide 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-aminoethyl)-N-butyl-2-propan-2-yloxyethanesulfonamide
CID 79600959
N-(3-amino-2-methylpropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide
CID 79594432
2-[ethyl(2-propan-2-yloxyethylsulfonyl)amino]ethanimidamide
CID 79600077
3-amino-N-ethyl-N-propylpropane-1-sulfonamide
CID 60910344
N-(2-aminoethyl)-N-ethyl-3-methoxypropane-1-sulfonamide
CID 63290294
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-propan-2-yloxyethanesulfonamide
CID 107483600
N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide
CID 118241668
N-(3-aminopropyl)-N-(2-methoxyethyl)butane-1-sulfonamide
CID 63287729
N-(3-aminopropyl)-N-methyl-3-propan-2-yloxypropanamide
CID 43254246
N-[(4-aminophenyl)methyl]-2-propan-2-yloxy-N-propylethanesulfonamide
CID 79592394
3-[2-methylpropyl(2-propan-2-yloxyethylsulfonyl)amino]propanimidamide
CID 79600343
2-[ethyl(2-propan-2-yloxyethylsulfonyl)amino]-2-methylpropanoic acid
CID 79594364

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide?
The IUPAC name of N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide (CID 79594690) is N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide.
What is the SMILES notation for N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide?
The canonical SMILES for N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide is CCN(CCCN)S(=O)(=O)CCOC(C)C.
What is the InChIKey of N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide?
The InChIKey is UVHVUZULGMNCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3S/c1-4-12(7-5-6-11)16(13,14)9-8-15-10(2)3/h10H,4-9,11H2,1-3H3.
What are the key properties of N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide?
N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide has a molecular weight of 252.38 g/mol, XLogP of 0.41, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-ethyl-2-propan-2-yloxyethanesulfonamide is sourced from PubChem (CID 79594690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).