N-[(3-methylphenyl)methyl]cyclopropanesulfonamide

C11H15NO2S — CID 118928947

IUPACN-[(3-methylphenyl)methyl]cyclopropanesulfonamide
SMILESCc1cccc(CNS(=O)(=O)C2CC2)c1
InChIInChI=1S/C11H15NO2S/c1-9-3-2-4-10(7-9)8-12-15(13,14)11-5-6-11/h2-4,7,11-12H,5-6,8H2,1H3
InChIKeyWAUYUIGGMFKJRP-UHFFFAOYSA-N
MW225.31 g/mol
LogP1.58
Rot. Bonds4

About N-[(3-methylphenyl)methyl]cyclopropanesulfonamide

N-[(3-methylphenyl)methyl]cyclopropanesulfonamide (PubChem CID 118928947) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is N-[(3-methylphenyl)methyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[(3-methylphenyl)methyl]cyclopropanesulfonamide
PubChem CID118928947
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC NameN-[(3-methylphenyl)methyl]cyclopropanesulfonamide
SMILESCc1cccc(CNS(=O)(=O)C2CC2)c1
InChIInChI=1S/C11H15NO2S/c1-9-3-2-4-10(7-9)8-12-15(13,14)11-5-6-11/h2-4,7,11-12H,5-6,8H2,1H3
InChIKeyWAUYUIGGMFKJRP-UHFFFAOYSA-N
XLogP1.58
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 66917095
methyl 2-[(3-methylphenyl)methylsulfamoyl]cyclopentane-1-carboxylate
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1-[(dimethylsulfamoylamino)methyl]-3-methylbenzene
CID 35383494
N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]cyclopropanesulfonamide
CID 146074496
N-[(3-bromophenyl)methyl]-1,1-dioxothiane-4-sulfonamide
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N-[(3-methylphenyl)methyl]cyclopropanamine
CID 16776498
N-[(2R)-2-[[3-(hydroxymethyl)phenyl]methylamino]propyl]cyclopropanesulfonamide
CID 125435236
3-(3-fluorophenyl)-2-methyl-N-[(3-methylphenyl)methyl]-1,2-oxazolidine-4-sulfonamide
CID 42869560
N-[(3-methylphenyl)methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 39984880
N-(cyclopropylmethyl)-6-[(3-methylphenyl)methylamino]pyridine-3-sulfonamide
CID 133316561
3-amino-2-methyl-N-[(3-methylphenyl)methyl]benzenesulfonamide
CID 60902763
(3R,4R)-2-methyl-N-[(3-methylphenyl)methyl]-3-[4-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-sulfonamide
CID 93000102

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylphenyl)methyl]cyclopropanesulfonamide?
The IUPAC name of N-[(3-methylphenyl)methyl]cyclopropanesulfonamide (CID 118928947) is N-[(3-methylphenyl)methyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[(3-methylphenyl)methyl]cyclopropanesulfonamide?
The canonical SMILES for N-[(3-methylphenyl)methyl]cyclopropanesulfonamide is Cc1cccc(CNS(=O)(=O)C2CC2)c1.
What is the InChIKey of N-[(3-methylphenyl)methyl]cyclopropanesulfonamide?
The InChIKey is WAUYUIGGMFKJRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-9-3-2-4-10(7-9)8-12-15(13,14)11-5-6-11/h2-4,7,11-12H,5-6,8H2,1H3.
What are the key properties of N-[(3-methylphenyl)methyl]cyclopropanesulfonamide?
N-[(3-methylphenyl)methyl]cyclopropanesulfonamide has a molecular weight of 225.31 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylphenyl)methyl]cyclopropanesulfonamide is sourced from PubChem (CID 118928947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).