N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide

C15H17ClN2O3S2 — CID 113059786

IUPACN-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
SMILESCC(=O)N(CCNS(=O)(=O)c1cccs1)c1cccc(Cl)c1C
InChIInChI=1S/C15H17ClN2O3S2/c1-11-13(16)5-3-6-14(11)18(12(2)19)9-8-17-23(20,21)15-7-4-10-22-15/h3-7,10,17H,8-9H2,1-2H3
InChIKeyGNHFQZUYHHKHRY-UHFFFAOYSA-N
MW372.90 g/mol
LogP3.04
Rot. Bonds6

About N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide

N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide (PubChem CID 113059786) has the molecular formula C15H17ClN2O3S2 and a molecular weight of 372.90 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
PubChem CID113059786
Molecular FormulaC15H17ClN2O3S2
Molecular Weight372.90 g/mol
Exact Mass372.04
IUPAC NameN-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide
SMILESCC(=O)N(CCNS(=O)(=O)c1cccs1)c1cccc(Cl)c1C
InChIInChI=1S/C15H17ClN2O3S2/c1-11-13(16)5-3-6-14(11)18(12(2)19)9-8-17-23(20,21)15-7-4-10-22-15/h3-7,10,17H,8-9H2,1-2H3
InChIKeyGNHFQZUYHHKHRY-UHFFFAOYSA-N
XLogP3.04
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.90
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide (CID 113059786) is N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide is CC(=O)N(CCNS(=O)(=O)c1cccs1)c1cccc(Cl)c1C.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
The InChIKey is GNHFQZUYHHKHRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O3S2/c1-11-13(16)5-3-6-14(11)18(12(2)19)9-8-17-23(20,21)15-7-4-10-22-15/h3-7,10,17H,8-9H2,1-2H3.
What are the key properties of N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide?
N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide has a molecular weight of 372.90 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-N-[2-(thiophen-2-ylsulfonylamino)ethyl]acetamide is sourced from PubChem (CID 113059786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).