N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide

C15H31NO6S — CID 167408580

IUPACN-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide
SMILESCC(C)OCCOCC(=O)N(C)CCOCCS(=O)(=O)C(C)C
InChIInChI=1S/C15H31NO6S/c1-13(2)22-9-8-21-12-15(17)16(5)6-7-20-10-11-23(18,19)14(3)4/h13-14H,6-12H2,1-5H3
InChIKeyODWBRKCBXMKMHM-UHFFFAOYSA-N
MW353.48 g/mol
LogP0.73
Rot. Bonds13

About N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide

N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide (PubChem CID 167408580) has the molecular formula C15H31NO6S and a molecular weight of 353.48 g/mol. Its IUPAC name is N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide
PubChem CID167408580
Molecular FormulaC15H31NO6S
Molecular Weight353.48 g/mol
Exact Mass353.19
IUPAC NameN-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide
SMILESCC(C)OCCOCC(=O)N(C)CCOCCS(=O)(=O)C(C)C
InChIInChI=1S/C15H31NO6S/c1-13(2)22-9-8-21-12-15(17)16(5)6-7-20-10-11-23(18,19)14(3)4/h13-14H,6-12H2,1-5H3
InChIKeyODWBRKCBXMKMHM-UHFFFAOYSA-N
XLogP0.73
TPSA82.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.48
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide 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,N-dimethyl-2-(2-propan-2-yloxyethoxy)acetamide
CID 172604090
2-[2-[methyl(propan-2-yl)amino]ethoxy]-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide
CID 176734991
N-(3-aminopropyl)-N-methyl-3-(2-propan-2-yloxyethoxy)propanamide
CID 43254229
N-methyl-2-[2-(methylamino)ethoxy]-N-[2-(2-methylsulfonylethoxy)ethyl]acetamide
CID 170359457
2-[2-(2-propan-2-yloxyethoxy)ethoxy]acetyl chloride
CID 71371862
N-(3-amino-3-sulfanylidenepropyl)-N-methyl-3-(2-propan-2-yloxyethoxy)propanamide
CID 43291188
1-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]propan-2-one
CID 170040791
N-[1,3-bis(4-methyl-3-oxopentoxy)propan-2-yl]-N-methyl-2-(2-propan-2-yloxyethoxy)acetamide
CID 167408503
N-methyl-2-(methylamino)-N-(2-propan-2-yloxyethyl)acetamide
CID 81056033
3-(iodoamino)-N-methyl-N-(2-propan-2-yloxyethyl)propanamide
CID 170371515
3-[2-(2-propan-2-yloxyethoxy)ethoxy]propanoic acid
CID 87458033
3-methyl-1-[2-(3-methyl-2-oxobutoxy)ethoxy]butan-2-one;2-(2-propan-2-yloxyethoxy)propane
CID 163475456

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide?
The IUPAC name of N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide (CID 167408580) is N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide.
What is the SMILES notation for N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide?
The canonical SMILES for N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide is CC(C)OCCOCC(=O)N(C)CCOCCS(=O)(=O)C(C)C.
What is the InChIKey of N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide?
The InChIKey is ODWBRKCBXMKMHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO6S/c1-13(2)22-9-8-21-12-15(17)16(5)6-7-20-10-11-23(18,19)14(3)4/h13-14H,6-12H2,1-5H3.
What are the key properties of N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide?
N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide has a molecular weight of 353.48 g/mol, XLogP of 0.73, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-propan-2-yloxyethoxy)-N-[2-(2-propan-2-ylsulfonylethoxy)ethyl]acetamide is sourced from PubChem (CID 167408580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).