N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride

C16H28ClN3O4S — CID 119592207

IUPACN-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride
SMILESCc1oc(C(=O)NC(CN)C2CCCCC2)cc1S(=O)(=O)N(C)C.Cl
InChIInChI=1S/C16H27N3O4S.ClH/c1-11-15(24(21,22)19(2)3)9-14(23-11)16(20)18-13(10-17)12-7-5-4-6-8-12;/h9,12-13H,4-8,10,17H2,1-3H3,(H,18,20);1H
InChIKeyYDJHGDXDLFAMJE-UHFFFAOYSA-N
MW393.94 g/mol
LogP1.90
Rot. Bonds6

About N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride

N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride (PubChem CID 119592207) has the molecular formula C16H28ClN3O4S and a molecular weight of 393.94 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride
PubChem CID119592207
Molecular FormulaC16H28ClN3O4S
Molecular Weight393.94 g/mol
Exact Mass393.15
IUPAC NameN-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride
SMILESCc1oc(C(=O)NC(CN)C2CCCCC2)cc1S(=O)(=O)N(C)C.Cl
InChIInChI=1S/C16H27N3O4S.ClH/c1-11-15(24(21,22)19(2)3)9-14(23-11)16(20)18-13(10-17)12-7-5-4-6-8-12;/h9,12-13H,4-8,10,17H2,1-3H3,(H,18,20);1H
InChIKeyYDJHGDXDLFAMJE-UHFFFAOYSA-N
XLogP1.90
TPSA105.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.94
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-1-cyclohexylethyl)-5-ethyl-4-methylfuran-2-carboxamide;hydrochloride
CID 119590238
N-(2-amino-1-cyclopentylethyl)-2,5-dimethylfuran-3-carboxamide
CID 106737497
N-[3-(aminomethyl)pentan-3-yl]-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride
CID 119572156
N-(1-amino-2,3-dimethylbutan-2-yl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride
CID 119609108
(2S)-2-[[4-(dimethylsulfamoyl)-5-methylfuran-2-carbonyl]amino]-4-methylpentanoic acid
CID 119361847
N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide
CID 81485921
N-(2-amino-1-cyclohexylethyl)-5-methylfuro[3,2-b]pyridine-2-carboxamide
CID 119592125
N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide
CID 119589648
4-(dimethylsulfamoyl)-5-methyl-N-(2-methylpiperidin-3-yl)furan-2-carboxamide
CID 120575686
N-(2-amino-1-cyclohexylethyl)-3-[methyl(propan-2-yl)sulfamoyl]benzamide;hydrochloride
CID 119590640
N-(2-amino-1-cyclohexylethyl)-3,5-dimethoxy-4-methylbenzamide;hydrochloride
CID 119592013
N-(2-amino-1-cyclopropylethyl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide;hydrochloride
CID 119615923

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride (CID 119592207) is N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride is Cc1oc(C(=O)NC(CN)C2CCCCC2)cc1S(=O)(=O)N(C)C.Cl.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride?
The InChIKey is YDJHGDXDLFAMJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O4S.ClH/c1-11-15(24(21,22)19(2)3)9-14(23-11)16(20)18-13(10-17)12-7-5-4-6-8-12;/h9,12-13H,4-8,10,17H2,1-3H3,(H,18,20);1H.
What are the key properties of N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride?
N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride has a molecular weight of 393.94 g/mol, XLogP of 1.90, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride is sourced from PubChem (CID 119592207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).