4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride

C16H26ClN3O3S — CID 120713646

IUPAC4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride
SMILESCN(C)C(=O)c1ccc(S(=O)(=O)NC(CN)C2CCCC2)cc1.Cl
InChIInChI=1S/C16H25N3O3S.ClH/c1-19(2)16(20)13-7-9-14(10-8-13)23(21,22)18-15(11-17)12-5-3-4-6-12;/h7-10,12,15,18H,3-6,11,17H2,1-2H3;1H
InChIKeyIXQBQWRXIYRYHP-UHFFFAOYSA-N
MW375.92 g/mol
LogP1.61
Rot. Bonds6

About 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride

4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride (PubChem CID 120713646) has the molecular formula C16H26ClN3O3S and a molecular weight of 375.92 g/mol. Its IUPAC name is 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride.

Molecular Properties

Compound Name4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride
PubChem CID120713646
Molecular FormulaC16H26ClN3O3S
Molecular Weight375.92 g/mol
Exact Mass375.14
IUPAC Name4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride
SMILESCN(C)C(=O)c1ccc(S(=O)(=O)NC(CN)C2CCCC2)cc1.Cl
InChIInChI=1S/C16H25N3O3S.ClH/c1-19(2)16(20)13-7-9-14(10-8-13)23(21,22)18-15(11-17)12-5-3-4-6-12;/h7-10,12,15,18H,3-6,11,17H2,1-2H3;1H
InChIKeyIXQBQWRXIYRYHP-UHFFFAOYSA-N
XLogP1.61
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.92
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-amino-1-cyclopentylethyl)sulfamoyl]benzamide
CID 106737961
N-(2-amino-1-cyclopentylethyl)-4-chlorobenzenesulfonamide
CID 106737819
N-[4-[(2-amino-1-cyclopentylethyl)sulfamoyl]phenyl]propanamide;hydrochloride
CID 120585027
N-(2-amino-1-cyclohexylethyl)benzenesulfonamide
CID 61122381
N-(2-amino-1-cyclopentylethyl)-4-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 120585169
N-(2-amino-1-cyclopentylethyl)-4-nitrobenzenesulfonamide;hydrochloride
CID 86820092
N-(2-amino-1-cyclohexylethyl)-4-(methylsulfamoyl)benzamide;hydrochloride
CID 119589468
methyl 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-2-methylbenzoate;hydrochloride
CID 120585325
N-(2-amino-1-cyclohexylethyl)-4-(butan-2-ylsulfamoyl)benzamide
CID 119591487
4-N-(2-amino-1-cyclopropylethyl)-1-N-cyclopropylbenzene-1,4-disulfonamide
CID 119986909
4-(1-aminohexan-2-ylsulfamoyl)-N,N-dimethylbenzamide;hydrochloride
CID 120712524
methyl 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-3-methylbenzoate;hydrochloride
CID 120585033

Frequently Asked Questions

What is the IUPAC name of 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride?
The IUPAC name of 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride (CID 120713646) is 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride.
What is the SMILES notation for 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride?
The canonical SMILES for 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride is CN(C)C(=O)c1ccc(S(=O)(=O)NC(CN)C2CCCC2)cc1.Cl.
What is the InChIKey of 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride?
The InChIKey is IXQBQWRXIYRYHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3S.ClH/c1-19(2)16(20)13-7-9-14(10-8-13)23(21,22)18-15(11-17)12-5-3-4-6-12;/h7-10,12,15,18H,3-6,11,17H2,1-2H3;1H.
What are the key properties of 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride?
4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride has a molecular weight of 375.92 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-amino-1-cyclopentylethyl)sulfamoyl]-N,N-dimethylbenzamide;hydrochloride is sourced from PubChem (CID 120713646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).