3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride

C19H24ClN3O3S — CID 119730951

IUPAC3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2CCC(N)C2)cc1S(=O)(=O)Nc1ccccc1.Cl
InChIInChI=1S/C19H23N3O3S.ClH/c1-13-7-10-17(21-19(23)14-8-9-15(20)11-14)12-18(13)26(24,25)22-16-5-3-2-4-6-16;/h2-7,10,12,14-15,22H,8-9,11,20H2,1H3,(H,21,23);1H
InChIKeyINXQLOZMYFBHIK-UHFFFAOYSA-N
MW409.94 g/mol
LogP3.28
Rot. Bonds5

About 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride

3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119730951) has the molecular formula C19H24ClN3O3S and a molecular weight of 409.94 g/mol. Its IUPAC name is 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119730951
Molecular FormulaC19H24ClN3O3S
Molecular Weight409.94 g/mol
Exact Mass409.12
IUPAC Name3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCc1ccc(NC(=O)C2CCC(N)C2)cc1S(=O)(=O)Nc1ccccc1.Cl
InChIInChI=1S/C19H23N3O3S.ClH/c1-13-7-10-17(21-19(23)14-8-9-15(20)11-14)12-18(13)26(24,25)22-16-5-3-2-4-6-16;/h2-7,10,12,14-15,22H,8-9,11,20H2,1H3,(H,21,23);1H
InChIKeyINXQLOZMYFBHIK-UHFFFAOYSA-N
XLogP3.28
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.94
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide
CID 119730952
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3-amino-N-(3,4-dimethylphenyl)cyclopentane-1-carboxamide;hydrochloride
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3-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclohexane-1-carboxamide
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3-amino-N-[3-(methylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119731804
N-[3-[(4-chlorophenyl)sulfamoyl]-4-methylphenyl]cyclobutanecarboxamide
CID 9243824
cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
CID 56906171
N-[3-[(5-tert-butyl-2-methylphenyl)sulfonylamino]phenyl]cyclopropanecarboxamide
CID 30805403
N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119679353
3-amino-N-[3-(dimethylamino)-4-methylphenyl]cyclopentane-1-carboxamide
CID 115377268
3-amino-N-(4-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670946

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride (CID 119730951) is 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride is Cc1ccc(NC(=O)C2CCC(N)C2)cc1S(=O)(=O)Nc1ccccc1.Cl.
What is the InChIKey of 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is INXQLOZMYFBHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S.ClH/c1-13-7-10-17(21-19(23)14-8-9-15(20)11-14)12-18(13)26(24,25)22-16-5-3-2-4-6-16;/h2-7,10,12,14-15,22H,8-9,11,20H2,1H3,(H,21,23);1H.
What are the key properties of 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 409.94 g/mol, XLogP of 3.28, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-methyl-3-(phenylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119730951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).