(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide

C15H25N3O3S — CID 119269826

IUPAC(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)[C@@H](C)N)cc1
InChIInChI=1S/C15H25N3O3S/c1-5-18(6-2)22(20,21)14-9-7-13(8-10-14)12(4)17-15(19)11(3)16/h7-12H,5-6,16H2,1-4H3,(H,17,19)/t11-,12?/m1/s1
InChIKeySSQIKGZRBBHZEV-JHJMLUEUSA-N
MW327.45 g/mol
LogP1.24
Rot. Bonds7

About (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide

(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide (PubChem CID 119269826) has the molecular formula C15H25N3O3S and a molecular weight of 327.45 g/mol. Its IUPAC name is (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide
PubChem CID119269826
Molecular FormulaC15H25N3O3S
Molecular Weight327.45 g/mol
Exact Mass327.16
IUPAC Name(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)[C@@H](C)N)cc1
InChIInChI=1S/C15H25N3O3S/c1-5-18(6-2)22(20,21)14-9-7-13(8-10-14)12(4)17-15(19)11(3)16/h7-12H,5-6,16H2,1-4H3,(H,17,19)/t11-,12?/m1/s1
InChIKeySSQIKGZRBBHZEV-JHJMLUEUSA-N
XLogP1.24
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.45
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide;hydrochloride
CID 119269825
3-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]butanamide;hydrochloride
CID 119686834
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-2-phenoxypropanamide
CID 55339007
N-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-methylbut-2-enamide
CID 31540675
(2R)-2-amino-N-[1-(4-methylsulfonylphenyl)ethyl]propanamide;hydrochloride
CID 119274664
N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide
CID 31526246
2-(4-bromophenoxy)-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide
CID 112765400
(2S)-2-amino-N-[1-[4-(methylsulfamoyl)phenyl]ethyl]propanamide
CID 119304077
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-iodobenzamide
CID 55339070
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-2,6-difluorobenzamide
CID 51151532
2-anilino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]acetamide
CID 119686819
1-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-[(1R)-1-(3,4-difluorophenyl)ethyl]urea
CID 52535105

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide (CID 119269826) is (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide is CCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)[C@@H](C)N)cc1.
What is the InChIKey of (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide?
The InChIKey is SSQIKGZRBBHZEV-JHJMLUEUSA-N. The full InChI is InChI=1S/C15H25N3O3S/c1-5-18(6-2)22(20,21)14-9-7-13(8-10-14)12(4)17-15(19)11(3)16/h7-12H,5-6,16H2,1-4H3,(H,17,19)/t11-,12?/m1/s1.
What are the key properties of (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide?
(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide has a molecular weight of 327.45 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide is sourced from PubChem (CID 119269826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).