N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide

C12H11NO3S2 — CID 11140539

IUPACN-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccccc1C(=O)c1cccs1
InChIInChI=1S/C12H11NO3S2/c1-18(15,16)13-10-6-3-2-5-9(10)12(14)11-7-4-8-17-11/h2-8,13H,1H3
InChIKeyACZVMFBUOKLNRV-UHFFFAOYSA-N
MW281.36 g/mol
LogP2.35
Rot. Bonds4

About N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide

N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide (PubChem CID 11140539) has the molecular formula C12H11NO3S2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide
PubChem CID11140539
Molecular FormulaC12H11NO3S2
Molecular Weight281.36 g/mol
Exact Mass281.02
IUPAC NameN-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccccc1C(=O)c1cccs1
InChIInChI=1S/C12H11NO3S2/c1-18(15,16)13-10-6-3-2-5-9(10)12(14)11-7-4-8-17-11/h2-8,13H,1H3
InChIKeyACZVMFBUOKLNRV-UHFFFAOYSA-N
XLogP2.35
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}

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Related Compounds

N-[2-(thiophene-2-carbonyl)phenyl]acetamide
CID 18987253
N-[2-[2-[(1,1,1-trifluoro-4-oxo-4-thiophen-2-ylbutan-2-ylidene)amino]acetyl]phenyl]methanesulfonamide
CID 58237865
N-[2-(ethylamino)ethyl]-2-(thiophene-2-carbonyl)benzamide;hydrochloride
CID 119508490
N-[1-[[2-(methanesulfonamido)phenyl]methylamino]-1-oxopropan-2-yl]thiophene-2-carboxamide
CID 55723714
[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethyl] 2-(methanesulfonamido)benzoate
CID 7247664
[3-(thiophene-2-carbonyl)naphthalen-2-yl]-thiophen-2-ylmethanone
CID 5082064
2-(methanesulfonamido)-N-[(3-methylthiophen-2-yl)methyl]benzamide
CID 39584251
4-[2-(methanesulfonamido)phenyl]-4-oxobutanoic acid
CID 154453322
(2-methylthiophen-3-yl)-thiophen-2-ylmethanone
CID 102830577
(2-methoxy-2-oxoethyl) 2-(thiophene-2-carbonyl)benzoate
CID 18151557
N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-N-[2-(methanesulfonamido)phenyl]thiophene-2-carboxamide
CID 70131199
2-(methanesulfonamido)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]benzamide
CID 25335311

Frequently Asked Questions

What is the IUPAC name of N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide?
The IUPAC name of N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide (CID 11140539) is N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide.
What is the SMILES notation for N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide?
The canonical SMILES for N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide is CS(=O)(=O)Nc1ccccc1C(=O)c1cccs1.
What is the InChIKey of N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide?
The InChIKey is ACZVMFBUOKLNRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO3S2/c1-18(15,16)13-10-6-3-2-5-9(10)12(14)11-7-4-8-17-11/h2-8,13H,1H3.
What are the key properties of N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide?
N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide has a molecular weight of 281.36 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(thiophene-2-carbonyl)phenyl]methanesulfonamide is sourced from PubChem (CID 11140539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).