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

C16H26ClN3O3S — CID 119800484

IUPAC3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCCCCS(=O)(=O)Nc1ccc(NC(=O)C2CCC(N)C2)cc1.Cl
InChIInChI=1S/C16H25N3O3S.ClH/c1-2-3-10-23(21,22)19-15-8-6-14(7-9-15)18-16(20)12-4-5-13(17)11-12;/h6-9,12-13,19H,2-5,10-11,17H2,1H3,(H,18,20);1H
InChIKeyJEWHKOSENLEBSM-UHFFFAOYSA-N
MW375.92 g/mol
LogP2.72
Rot. Bonds7

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

3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119800484) has the molecular formula C16H26ClN3O3S and a molecular weight of 375.92 g/mol. Its IUPAC name is 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119800484
Molecular FormulaC16H26ClN3O3S
Molecular Weight375.92 g/mol
Exact Mass375.14
IUPAC Name3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCCCCS(=O)(=O)Nc1ccc(NC(=O)C2CCC(N)C2)cc1.Cl
InChIInChI=1S/C16H25N3O3S.ClH/c1-2-3-10-23(21,22)19-15-8-6-14(7-9-15)18-16(20)12-4-5-13(17)11-12;/h6-9,12-13,19H,2-5,10-11,17H2,1H3,(H,18,20);1H
InChIKeyJEWHKOSENLEBSM-UHFFFAOYSA-N
XLogP2.72
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.92
LogP ≤ 52.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-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

3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide
CID 119800485
3-amino-N-[4-(butylsulfonylamino)phenyl]cyclohexane-1-carboxamide
CID 119800489
3-amino-N-[4-(ethylsulfonylamino)phenyl]cyclohexane-1-carboxamide
CID 119711119
3-amino-N-(4-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670946
3-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670664
3-amino-N-[4-(methanesulfonamido)phenyl]cyclohexane-1-carboxamide
CID 63044303
N-[4-(butylsulfonylamino)phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119800501
3-amino-N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119700136
3-amino-N-(4-chlorophenyl)cyclopentane-1-carboxamide
CID 66031270
3-amino-N-[4-(2-amino-2-oxoethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119711689
3-amino-N-[4-(propanoylamino)phenyl]cyclohexane-1-carboxamide
CID 63044136
methyl 4-[(3-aminocyclopentanecarbonyl)amino]benzoate;hydrochloride
CID 119671365

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride (CID 119800484) is 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride is CCCCS(=O)(=O)Nc1ccc(NC(=O)C2CCC(N)C2)cc1.Cl.
What is the InChIKey of 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is JEWHKOSENLEBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3S.ClH/c1-2-3-10-23(21,22)19-15-8-6-14(7-9-15)18-16(20)12-4-5-13(17)11-12;/h6-9,12-13,19H,2-5,10-11,17H2,1H3,(H,18,20);1H.
What are the key properties of 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride?
3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 375.92 g/mol, XLogP of 2.72, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-(butylsulfonylamino)phenyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119800484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).