1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

C14H22ClN3O3S — CID 119293957

IUPAC1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCNS(=O)(=O)c1cccc(NC(=O)C2(N)CCCCC2)c1.Cl
InChIInChI=1S/C14H21N3O3S.ClH/c1-16-21(19,20)12-7-5-6-11(10-12)17-13(18)14(15)8-3-2-4-9-14;/h5-7,10,16H,2-4,8-9,15H2,1H3,(H,17,18);1H
InChIKeyJTARASOLYWSLKJ-UHFFFAOYSA-N
MW347.87 g/mol
LogP1.62
Rot. Bonds4

About 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride

1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119293957) has the molecular formula C14H22ClN3O3S and a molecular weight of 347.87 g/mol. Its IUPAC name is 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
PubChem CID119293957
Molecular FormulaC14H22ClN3O3S
Molecular Weight347.87 g/mol
Exact Mass347.11
IUPAC Name1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCNS(=O)(=O)c1cccc(NC(=O)C2(N)CCCCC2)c1.Cl
InChIInChI=1S/C14H21N3O3S.ClH/c1-16-21(19,20)12-7-5-6-11(10-12)17-13(18)14(15)8-3-2-4-9-14;/h5-7,10,16H,2-4,8-9,15H2,1H3,(H,17,18);1H
InChIKeyJTARASOLYWSLKJ-UHFFFAOYSA-N
XLogP1.62
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.87
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide
CID 119283953
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CID 119341523
1-amino-N-[3-(benzenesulfonamido)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119282587
1-amino-N-[3-(1,3-thiazol-2-ylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119341551
1-amino-N-[4-(methylsulfamoyl)phenyl]cyclobutane-1-carboxamide
CID 81178892
3-methyl-N-[3-(methylsulfamoyl)phenyl]piperidine-3-carboxamide
CID 63130562
1-amino-N-[3-(methoxymethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119288741
1-amino-N-[3-(sulfamoylmethyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119308070
1-amino-N-[3-(2-methylpropanoylamino)phenyl]cyclopentane-1-carboxamide
CID 60854804
1-amino-N-(3-methoxyphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119261882
1-amino-N-[3-(sulfamoylmethyl)phenyl]cyclohexane-1-carboxamide
CID 119308071
1-amino-N-[3-[methyl(propan-2-yl)amino]phenyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119883155

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride (CID 119293957) is 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is CNS(=O)(=O)c1cccc(NC(=O)C2(N)CCCCC2)c1.Cl.
What is the InChIKey of 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is JTARASOLYWSLKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S.ClH/c1-16-21(19,20)12-7-5-6-11(10-12)17-13(18)14(15)8-3-2-4-9-14;/h5-7,10,16H,2-4,8-9,15H2,1H3,(H,17,18);1H.
What are the key properties of 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride?
1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 347.87 g/mol, XLogP of 1.62, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-(methylsulfamoyl)phenyl]cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119293957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).