N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide

C12H11ClN2O3S2 — CID 893603

IUPACN-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
InChIInChI=1S/C12H11ClN2O3S2/c1-8(16)14-9-2-4-10(5-3-9)15-20(17,18)12-7-6-11(13)19-12/h2-7,15H,1H3,(H,14,16)
InChIKeyCGUYJWPUWLHQNB-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.16
Rot. Bonds4

About N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide

N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide (PubChem CID 893603) has the molecular formula C12H11ClN2O3S2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide
PubChem CID893603
Molecular FormulaC12H11ClN2O3S2
Molecular Weight330.82 g/mol
Exact Mass329.99
IUPAC NameN-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
InChIInChI=1S/C12H11ClN2O3S2/c1-8(16)14-9-2-4-10(5-3-9)15-20(17,18)12-7-6-11(13)19-12/h2-7,15H,1H3,(H,14,16)
InChIKeyCGUYJWPUWLHQNB-UHFFFAOYSA-N
XLogP3.16
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N1-(4-chlorophenyl)-2-(2-thienylthio)acetamide
CID 2819664
Sulfonamide deriv., 5c
CID 44520898
2,5-dichloro-N-(4-piperidin-1-ylphenyl)thiophene-3-sulfonamide
CID 2813371
2-bromo-N-(2,5-dichlorothiophen-3-ylsulfonyl)-N-phenylacetamide
CID 49798556
2-bromo-N-(4-chlorophenyl)-N-(2,5-dichlorothiophen-3-ylsulfonyl)acetamide
CID 49798557
2,5-dichloro-N-(4-sulfamoylphenyl)thiophene-3-carboxamide
CID 4524487
N-(4-{[(2,5-dimethyl-3-thienyl)sulfonyl]amino}phenyl)acetamide
CID 715043
3-(5-Bromothiophene-2-sulfonamido)-N-(4-chlorophenyl)propanamide
CID 9550299
N-[4-(acetylsulfamoyl)phenyl]-2-(4-chlorophenyl)sulfanylacetamide
CID 1327534
2-((5-chlorothiophen-2-yl)sulfonyl)-N-(3-(trifluoromethyl)phenyl)acetamide
CID 42100194
1-(4-Chlorophenyl)-3-(4,5-dimethylthiophen-2-yl)sulfonylurea
CID 9819534
N-[(4-Chlorophenyl)carbamoyl]thiophene-2-sulfonamide
CID 15669317

Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide (CID 893603) is N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide is CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1.
What is the InChIKey of N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide?
The InChIKey is CGUYJWPUWLHQNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O3S2/c1-8(16)14-9-2-4-10(5-3-9)15-20(17,18)12-7-6-11(13)19-12/h2-7,15H,1H3,(H,14,16).
What are the key properties of N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide?
N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide has a molecular weight of 330.82 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 893603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).