N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide

C19H25N3O3S2 — CID 70680664

IUPACN-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(-c2csc(NC(=O)C3CCCC3)n2)cc1
InChIInChI=1S/C19H25N3O3S2/c1-3-22(4-2)27(24,25)16-11-9-14(10-12-16)17-13-26-19(20-17)21-18(23)15-7-5-6-8-15/h9-13,15H,3-8H2,1-2H3,(H,20,21,23)
InChIKeyZAPJZEQWCWYIPF-UHFFFAOYSA-N
MW407.56 g/mol
LogP3.97
Rot. Bonds7

About N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide

N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide (PubChem CID 70680664) has the molecular formula C19H25N3O3S2 and a molecular weight of 407.56 g/mol. Its IUPAC name is N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide
PubChem CID70680664
Molecular FormulaC19H25N3O3S2
Molecular Weight407.56 g/mol
Exact Mass407.13
IUPAC NameN-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(-c2csc(NC(=O)C3CCCC3)n2)cc1
InChIInChI=1S/C19H25N3O3S2/c1-3-22(4-2)27(24,25)16-11-9-14(10-12-16)17-13-26-19(20-17)21-18(23)15-7-5-6-8-15/h9-13,15H,3-8H2,1-2H3,(H,20,21,23)
InChIKeyZAPJZEQWCWYIPF-UHFFFAOYSA-N
XLogP3.97
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.56
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[4-(dimethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopropanecarboxamide
CID 70680665
N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 9246504
N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]cyclobutanecarboxamide
CID 9246518
N,N-diethyl-4-[2-(methylamino)-1,3-thiazol-4-yl]benzenesulfonamide
CID 9343639
N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]-2-[2-[ethyl-[4-[2-(2-methylpropanoylamino)-1,3-thiazol-4-yl]phenyl]sulfonylamino]ethyl]cyclopropane-1-carboxamide
CID 123186166
N-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
CID 2163654
4-(diethylsulfamoyl)-N-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]benzamide
CID 998509
N,N-diethyl-4-[2-(propylamino)-1,3-thiazol-4-yl]benzenesulfonamide
CID 9343482
ethane;molecular hydrogen;N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]cyclopropanecarboxamide
CID 144915932
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]cyclobutanecarboxamide
CID 1225742
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]cyclobutanecarboxamide
CID 7733333
4-tert-butyl-N-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]cyclohexane-1-carboxamide
CID 9246533

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide?
The IUPAC name of N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide (CID 70680664) is N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide is CCN(CC)S(=O)(=O)c1ccc(-c2csc(NC(=O)C3CCCC3)n2)cc1.
What is the InChIKey of N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide?
The InChIKey is ZAPJZEQWCWYIPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3S2/c1-3-22(4-2)27(24,25)16-11-9-14(10-12-16)17-13-26-19(20-17)21-18(23)15-7-5-6-8-15/h9-13,15H,3-8H2,1-2H3,(H,20,21,23).
What are the key properties of N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide?
N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide has a molecular weight of 407.56 g/mol, XLogP of 3.97, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(diethylsulfamoyl)phenyl]-1,3-thiazol-2-yl]cyclopentanecarboxamide is sourced from PubChem (CID 70680664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).