N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride

C14H24ClN3O4S — CID 119504724

IUPACN-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride
SMILESCCNCCNC(=O)c1cccc(S(=O)(=O)NCCOC)c1.Cl
InChIInChI=1S/C14H23N3O4S.ClH/c1-3-15-7-8-16-14(18)12-5-4-6-13(11-12)22(19,20)17-9-10-21-2;/h4-6,11,15,17H,3,7-10H2,1-2H3,(H,16,18);1H
InChIKeyKFYCRIDJDRPFEV-UHFFFAOYSA-N
MW365.88 g/mol
LogP0.37
Rot. Bonds10

About N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride

N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride (PubChem CID 119504724) has the molecular formula C14H24ClN3O4S and a molecular weight of 365.88 g/mol. Its IUPAC name is N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride
PubChem CID119504724
Molecular FormulaC14H24ClN3O4S
Molecular Weight365.88 g/mol
Exact Mass365.12
IUPAC NameN-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride
SMILESCCNCCNC(=O)c1cccc(S(=O)(=O)NCCOC)c1.Cl
InChIInChI=1S/C14H23N3O4S.ClH/c1-3-15-7-8-16-14(18)12-5-4-6-13(11-12)22(19,20)17-9-10-21-2;/h4-6,11,15,17H,3,7-10H2,1-2H3,(H,16,18);1H
InChIKeyKFYCRIDJDRPFEV-UHFFFAOYSA-N
XLogP0.37
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.88
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 55565687
3-(2-methoxyethylsulfamoyl)-N-(3-methoxypropyl)benzamide
CID 55565589
3-(cyclopropylmethylsulfamoyl)-N-[2-(ethylamino)ethyl]benzamide;hydrochloride
CID 119508576
N-(2-aminoethyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 119382099
N-[2-(ethylaminomethyl)phenyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 119438772
N-[2-(dimethylamino)-2-oxoethyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 55565202
N-[(4-chlorophenyl)methyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 55565294
3-(2-methoxyethylsulfamoyl)-N-phenylbenzamide
CID 6463975
N-[2-(3-fluorophenoxy)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 35101237
N-(furan-2-ylmethyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 109063553
N-(2-methoxyethyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 26500829
N-(2-amino-2-phenylethyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 119527433

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride?
The IUPAC name of N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride (CID 119504724) is N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride.
What is the SMILES notation for N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride?
The canonical SMILES for N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride is CCNCCNC(=O)c1cccc(S(=O)(=O)NCCOC)c1.Cl.
What is the InChIKey of N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride?
The InChIKey is KFYCRIDJDRPFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O4S.ClH/c1-3-15-7-8-16-14(18)12-5-4-6-13(11-12)22(19,20)17-9-10-21-2;/h4-6,11,15,17H,3,7-10H2,1-2H3,(H,16,18);1H.
What are the key properties of N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride?
N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride has a molecular weight of 365.88 g/mol, XLogP of 0.37, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)ethyl]-3-(2-methoxyethylsulfamoyl)benzamide;hydrochloride is sourced from PubChem (CID 119504724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).