N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide

C15H25N3O4S — CID 2458881

IUPACN-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CNC[C@H](C)O)cc1
InChIInChI=1S/C15H25N3O4S/c1-4-18(5-2)23(21,22)14-8-6-13(7-9-14)17-15(20)11-16-10-12(3)19/h6-9,12,16,19H,4-5,10-11H2,1-3H3,(H,17,20)/t12-/m0/s1
InChIKeyRVJNJCLIHPFHSG-LBPRGKRZSA-N
MW343.45 g/mol
LogP0.63
Rot. Bonds9

About N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide

N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide (PubChem CID 2458881) has the molecular formula C15H25N3O4S and a molecular weight of 343.45 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide
PubChem CID2458881
Molecular FormulaC15H25N3O4S
Molecular Weight343.45 g/mol
Exact Mass343.16
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CNC[C@H](C)O)cc1
InChIInChI=1S/C15H25N3O4S/c1-4-18(5-2)23(21,22)14-8-6-13(7-9-14)17-15(20)11-16-10-12(3)19/h6-9,12,16,19H,4-5,10-11H2,1-3H3,(H,17,20)/t12-/m0/s1
InChIKeyRVJNJCLIHPFHSG-LBPRGKRZSA-N
XLogP0.63
TPSA98.74 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-bromo-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 46736589
N-(4-fluorophenyl)-2-(2-hydroxypropylamino)acetamide
CID 43389711
2-bromo-N-[4-(diethylsulfamoyl)phenyl]propanamide
CID 107903298
N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylphenyl)sulfanylacetamide
CID 9415957
N-[4-(diethylsulfamoyl)phenyl]-2-(3-fluoro-4-methylanilino)acetamide
CID 9100034
2-[[2-[4-(diethylsulfamoyl)anilino]-2-oxoethyl]-methylamino]-N-(4-methylphenyl)acetamide
CID 2459457
2-[4-(diethylsulfamoyl)anilino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 4846803
N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide
CID 8901829
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
2-[4-(diethylsulfamoyl)anilino]-N-naphthalen-2-ylacetamide
CID 9084099
N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ium-1-ylacetamide
CID 8901828
[2-[4-(diethylsulfamoyl)anilino]-2-oxoethyl] N,N-dimethylcarbamodithioate
CID 3251537

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide (CID 2458881) is N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)CNC[C@H](C)O)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide?
The InChIKey is RVJNJCLIHPFHSG-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H25N3O4S/c1-4-18(5-2)23(21,22)14-8-6-13(7-9-14)17-15(20)11-16-10-12(3)19/h6-9,12,16,19H,4-5,10-11H2,1-3H3,(H,17,20)/t12-/m0/s1.
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide?
N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide has a molecular weight of 343.45 g/mol, XLogP of 0.63, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-2-[[(2S)-2-hydroxypropyl]amino]acetamide is sourced from PubChem (CID 2458881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).