N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide

C11H25N3O4S — CID 113137638

IUPACN-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide
SMILESCOCCN(CCC(=O)NCCN(C)C)S(C)(=O)=O
InChIInChI=1S/C11H25N3O4S/c1-13(2)8-6-12-11(15)5-7-14(9-10-18-3)19(4,16)17/h5-10H2,1-4H3,(H,12,15)
InChIKeyXCUWWFMAVRMKTA-UHFFFAOYSA-N
MW295.40 g/mol
LogP-1.04
Rot. Bonds10

About N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide

N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide (PubChem CID 113137638) has the molecular formula C11H25N3O4S and a molecular weight of 295.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide
PubChem CID113137638
Molecular FormulaC11H25N3O4S
Molecular Weight295.40 g/mol
Exact Mass295.16
IUPAC NameN-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide
SMILESCOCCN(CCC(=O)NCCN(C)C)S(C)(=O)=O
InChIInChI=1S/C11H25N3O4S/c1-13(2)8-6-12-11(15)5-7-14(9-10-18-3)19(4,16)17/h5-10H2,1-4H3,(H,12,15)
InChIKeyXCUWWFMAVRMKTA-UHFFFAOYSA-N
XLogP-1.04
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.40
LogP ≤ 5-1.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 3-[2-methoxyethyl(methylsulfonyl)amino]propanoate
CID 78959529
3-[acetyl(2-methoxyethyl)amino]-N-[2-(dimethylamino)ethyl]propanamide
CID 113116886
methanesulfonic acid;2-methoxy-N,N-dimethylethanamine
CID 174574685
N-[2-(dimethylamino)ethyl]-3-[methylsulfonyl(propan-2-yl)amino]propanamide
CID 113136060
3-(dimethylamino)-N-[2-(2-methoxyethylamino)ethyl]propanamide
CID 83039390
3-[2-methoxyethyl(methylsulfonyl)amino]-N-(pyridin-3-ylmethyl)propanamide
CID 113137660
N-(3-methoxypropyl)-2-[methylsulfonyl(propyl)amino]acetamide
CID 113147465
N-[2-[2-methoxyethyl(methylsulfonyl)amino]ethyl]methanesulfonamide
CID 113066009
N-tert-butyl-3-[2-(dimethylamino)ethyl-methylsulfonylamino]propanamide
CID 113138136
N-[2-[2-(dimethylamino)ethyl-methylsulfonylamino]ethyl]-2-ethylbutanamide
CID 113066227
4-bromo-N-[2-[2-methoxyethyl(methylsulfonyl)amino]ethyl]benzamide
CID 113065961
3-[2-(dimethylamino)ethyl-methylsulfonylamino]-N-[(2-methoxyphenyl)methyl]propanamide
CID 113138110

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide (CID 113137638) is N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide is COCCN(CCC(=O)NCCN(C)C)S(C)(=O)=O.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide?
The InChIKey is XCUWWFMAVRMKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O4S/c1-13(2)8-6-12-11(15)5-7-14(9-10-18-3)19(4,16)17/h5-10H2,1-4H3,(H,12,15).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide?
N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide has a molecular weight of 295.40 g/mol, XLogP of -1.04, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-[2-methoxyethyl(methylsulfonyl)amino]propanamide is sourced from PubChem (CID 113137638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).