N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide

C11H10Cl2N2O2S2 — CID 84596338

IUPACN-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide
SMILESCN(Cc1ncc(Cl)cc1Cl)S(=O)(=O)c1cccs1
InChIInChI=1S/C11H10Cl2N2O2S2/c1-15(19(16,17)11-3-2-4-18-11)7-10-9(13)5-8(12)6-14-10/h2-6H,7H2,1H3
InChIKeyNMXDNWCDLDFDSB-UHFFFAOYSA-N
MW337.25 g/mol
LogP3.27
Rot. Bonds4

About N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide

N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide (PubChem CID 84596338) has the molecular formula C11H10Cl2N2O2S2 and a molecular weight of 337.25 g/mol. Its IUPAC name is N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide
PubChem CID84596338
Molecular FormulaC11H10Cl2N2O2S2
Molecular Weight337.25 g/mol
Exact Mass335.96
IUPAC NameN-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide
SMILESCN(Cc1ncc(Cl)cc1Cl)S(=O)(=O)c1cccs1
InChIInChI=1S/C11H10Cl2N2O2S2/c1-15(19(16,17)11-3-2-4-18-11)7-10-9(13)5-8(12)6-14-10/h2-6H,7H2,1H3
InChIKeyNMXDNWCDLDFDSB-UHFFFAOYSA-N
XLogP3.27
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.25
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(pyridin-4-ylmethyl)thiophene-2-sulfonamide
CID 47020933
(2,4-dichlorophenyl) 2-[methyl(thiophen-2-ylsulfonyl)amino]acetate
CID 16560681
N-ethyl-N-methylthiophene-2-sulfonamide;hydrochloride
CID 130616398
N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]thiophene-2-sulfonamide
CID 47454541
N-[(2-ethoxy-3-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide
CID 53184966
N-(2-chloropropyl)-N-methylthiophene-2-sulfonamide
CID 63397170
N-[(2-methoxyphenyl)methyl]-N-methylthiophene-2-sulfonamide
CID 2531281
N-(1H-benzimidazol-2-ylmethyl)-N-methylthiophene-2-sulfonamide
CID 35385383
N-(2,5-dichlorophenyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 30268370
N-[(5-bromothiophen-2-yl)methyl]-N-methylthiophene-2-sulfonamide
CID 9302453
N-butyl-N-methylthiophene-2-sulfonamide
CID 4992196
4-[[methyl(thiophen-2-ylsulfonyl)amino]methyl]benzoic acid
CID 60750528

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide?
The IUPAC name of N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide (CID 84596338) is N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide?
The canonical SMILES for N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide is CN(Cc1ncc(Cl)cc1Cl)S(=O)(=O)c1cccs1.
What is the InChIKey of N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide?
The InChIKey is NMXDNWCDLDFDSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2O2S2/c1-15(19(16,17)11-3-2-4-18-11)7-10-9(13)5-8(12)6-14-10/h2-6H,7H2,1H3.
What are the key properties of N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide?
N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide has a molecular weight of 337.25 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dichloro-2-pyridinyl)methyl]-N-methylthiophene-2-sulfonamide is sourced from PubChem (CID 84596338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).