N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride

C20H34ClN3O3S — CID 119667060

IUPACN-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride
SMILESCCCCC(CN)NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1.Cl
InChIInChI=1S/C20H33N3O3S.ClH/c1-3-4-8-17(15-21)22-20(24)16-11-13-19(14-12-16)27(25,26)23(2)18-9-6-5-7-10-18;/h11-14,17-18H,3-10,15,21H2,1-2H3,(H,22,24);1H
InChIKeyLGFKLNUATUINPV-UHFFFAOYSA-N
MW432.03 g/mol
LogP3.31
Rot. Bonds9

About N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride

N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride (PubChem CID 119667060) has the molecular formula C20H34ClN3O3S and a molecular weight of 432.03 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride
PubChem CID119667060
Molecular FormulaC20H34ClN3O3S
Molecular Weight432.03 g/mol
Exact Mass431.20
IUPAC NameN-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride
SMILESCCCCC(CN)NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1.Cl
InChIInChI=1S/C20H33N3O3S.ClH/c1-3-4-8-17(15-21)22-20(24)16-11-13-19(14-12-16)27(25,26)23(2)18-9-6-5-7-10-18;/h11-14,17-18H,3-10,15,21H2,1-2H3,(H,22,24);1H
InChIKeyLGFKLNUATUINPV-UHFFFAOYSA-N
XLogP3.31
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.03
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride (CID 119667060) is N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride is CCCCC(CN)NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride?
The InChIKey is LGFKLNUATUINPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N3O3S.ClH/c1-3-4-8-17(15-21)22-20(24)16-11-13-19(14-12-16)27(25,26)23(2)18-9-6-5-7-10-18;/h11-14,17-18H,3-10,15,21H2,1-2H3,(H,22,24);1H.
What are the key properties of N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride?
N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride has a molecular weight of 432.03 g/mol, XLogP of 3.31, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride is sourced from PubChem (CID 119667060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).