2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide

C13H18ClN3O3S — CID 61108815

IUPAC2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide
SMILESNC(=O)CN(C1CCCC1)S(=O)(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C13H18ClN3O3S/c14-9-5-6-11(15)12(7-9)21(19,20)17(8-13(16)18)10-3-1-2-4-10/h5-7,10H,1-4,8,15H2,(H2,16,18)
InChIKeyVZMWMZQYOAZQGW-UHFFFAOYSA-N
MW331.83 g/mol
LogP1.34
Rot. Bonds5

About 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide

2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide (PubChem CID 61108815) has the molecular formula C13H18ClN3O3S and a molecular weight of 331.83 g/mol. Its IUPAC name is 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide
PubChem CID61108815
Molecular FormulaC13H18ClN3O3S
Molecular Weight331.83 g/mol
Exact Mass331.08
IUPAC Name2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide
SMILESNC(=O)CN(C1CCCC1)S(=O)(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C13H18ClN3O3S/c14-9-5-6-11(15)12(7-9)21(19,20)17(8-13(16)18)10-3-1-2-4-10/h5-7,10H,1-4,8,15H2,(H2,16,18)
InChIKeyVZMWMZQYOAZQGW-UHFFFAOYSA-N
XLogP1.34
TPSA106.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.83
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-5-chloro-N-cyclobutyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 102859200
2-[(3-amino-2-methylphenyl)sulfonyl-cyclopentylamino]acetamide
CID 61108810
2-amino-5-chloro-N-cyclopropyl-N-(2-methylpropyl)benzenesulfonamide
CID 61111608
2-[(2-amino-5-chlorophenyl)sulfonyl-ethylamino]acetamide
CID 103101046
2-[(4-chloro-2-fluorophenyl)sulfonyl-cyclopentylamino]acetic acid
CID 60829623
2-[(5-bromo-2-methylphenyl)sulfonyl-cyclopentylamino]acetamide
CID 60539936
2-amino-5-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)benzenesulfonamide
CID 61112354
2-[(3-chloro-4-cyanophenyl)sulfonyl-cyclopentylamino]acetamide
CID 60539815
2-[(4-bromophenyl)sulfonyl-cyclohexylamino]acetamide
CID 1167474
2-[(3-chlorophenyl)sulfonyl-piperidin-4-ylamino]acetamide
CID 60801411
2-[(5-chloro-6-oxo-1H-pyridin-3-yl)sulfonyl-cyclopentylamino]acetamide
CID 64606928
5-chloro-N-cyclohexyl-2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide
CID 50788468

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide?
The IUPAC name of 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide (CID 61108815) is 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide.
What is the SMILES notation for 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide?
The canonical SMILES for 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide is NC(=O)CN(C1CCCC1)S(=O)(=O)c1cc(Cl)ccc1N.
What is the InChIKey of 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide?
The InChIKey is VZMWMZQYOAZQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O3S/c14-9-5-6-11(15)12(7-9)21(19,20)17(8-13(16)18)10-3-1-2-4-10/h5-7,10H,1-4,8,15H2,(H2,16,18).
What are the key properties of 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide?
2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide has a molecular weight of 331.83 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-5-chlorophenyl)sulfonyl-cyclopentylamino]acetamide is sourced from PubChem (CID 61108815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).