N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide

C15H25N3O3S — CID 43007092

IUPACN-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide
SMILESCCN(CC)CCNC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C15H25N3O3S/c1-5-18(6-2)11-10-16-15(19)13-8-7-9-14(12-13)22(20,21)17(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H,16,19)
InChIKeyMPPKSCSPARHLGR-UHFFFAOYSA-N
MW327.45 g/mol
LogP1.01
Rot. Bonds8

About N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide

N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide (PubChem CID 43007092) has the molecular formula C15H25N3O3S and a molecular weight of 327.45 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide
PubChem CID43007092
Molecular FormulaC15H25N3O3S
Molecular Weight327.45 g/mol
Exact Mass327.16
IUPAC NameN-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide
SMILESCCN(CC)CCNC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C15H25N3O3S/c1-5-18(6-2)11-10-16-15(19)13-8-7-9-14(12-13)22(20,21)17(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H,16,19)
InChIKeyMPPKSCSPARHLGR-UHFFFAOYSA-N
XLogP1.01
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.45
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(diethylsulfamoyl)-N-[2-(dimethylamino)ethyl]benzamide
CID 2196169
3-(diethylsulfamoyl)-N-propylbenzamide
CID 2709423
2-[[3-(dimethylsulfamoyl)benzoyl]amino]acetic acid
CID 2456563
2-[[3-(dimethylsulfamoyl)benzoyl]amino]acetate
CID 2456562
3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-(diethylamino)ethyl]benzamide
CID 19257232
3-bromo-N-[2-(diethylamino)ethyl]benzamide;hydrochloride
CID 2941785
3-[methyl(propan-2-yl)sulfamoyl]-N-propylbenzamide
CID 30878906
3-(dimethylsulfamoyl)-N-(3-piperidin-1-ylpropyl)benzamide
CID 43020134
N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)-4,5-dimethylbenzamide
CID 30550464
N-(2-cyclopentylsulfanylethyl)-3-(dimethylsulfamoyl)benzamide
CID 94101566
N-(2-aminoethyl)-3-[methyl(propan-2-yl)sulfamoyl]benzamide;hydrochloride
CID 119383832
N-[2-(4-tert-butylphenoxy)ethyl]-3-(dimethylsulfamoyl)benzamide
CID 27861724

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide (CID 43007092) is N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide is CCN(CC)CCNC(=O)c1cccc(S(=O)(=O)N(C)C)c1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide?
The InChIKey is MPPKSCSPARHLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3S/c1-5-18(6-2)11-10-16-15(19)13-8-7-9-14(12-13)22(20,21)17(3)4/h7-9,12H,5-6,10-11H2,1-4H3,(H,16,19).
What are the key properties of N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide?
N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide has a molecular weight of 327.45 g/mol, XLogP of 1.01, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-3-(dimethylsulfamoyl)benzamide is sourced from PubChem (CID 43007092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).