3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride

C15H26ClN3O3S — CID 119272848

IUPAC3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)CCN)c1.Cl
InChIInChI=1S/C15H25N3O3S.ClH/c1-5-18(6-2)22(20,21)13-9-11(3)12(4)14(10-13)17-15(19)7-8-16;/h9-10H,5-8,16H2,1-4H3,(H,17,19);1H
InChIKeySCJORSZEBAZCIJ-UHFFFAOYSA-N
MW363.91 g/mol
LogP2.04
Rot. Bonds7

About 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride

3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride (PubChem CID 119272848) has the molecular formula C15H26ClN3O3S and a molecular weight of 363.91 g/mol. Its IUPAC name is 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride
PubChem CID119272848
Molecular FormulaC15H26ClN3O3S
Molecular Weight363.91 g/mol
Exact Mass363.14
IUPAC Name3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)CCN)c1.Cl
InChIInChI=1S/C15H25N3O3S.ClH/c1-5-18(6-2)22(20,21)13-9-11(3)12(4)14(10-13)17-15(19)7-8-16;/h9-10H,5-8,16H2,1-4H3,(H,17,19);1H
InChIKeySCJORSZEBAZCIJ-UHFFFAOYSA-N
XLogP2.04
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.91
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 27832679
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-3-(2-nitroanilino)propanamide
CID 16962406
3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119692536
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 27832563
4-amino-N-(2,3-dimethyl-5-sulfamoylphenyl)butanamide
CID 43703344
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide
CID 119272853
2-(6-chloro-3-pyridinyl)-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]acetamide
CID 86933475
4-amino-N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]butanamide;hydrochloride
CID 119268072
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]pyrrolidine-3-carboxamide
CID 119692557
2-chloro-N-[5-(diethylsulfamoyl)-2-methylphenyl]acetamide
CID 3606084
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
CID 26977901
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 17446514

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride?
The IUPAC name of 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride (CID 119272848) is 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride?
The canonical SMILES for 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride is CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)CCN)c1.Cl.
What is the InChIKey of 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride?
The InChIKey is SCJORSZEBAZCIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3S.ClH/c1-5-18(6-2)22(20,21)13-9-11(3)12(4)14(10-13)17-15(19)7-8-16;/h9-10H,5-8,16H2,1-4H3,(H,17,19);1H.
What are the key properties of 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride?
3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride has a molecular weight of 363.91 g/mol, XLogP of 2.04, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride is sourced from PubChem (CID 119272848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).