N-(2,4-dimethylphenyl)morpholine-4-sulfonamide

C12H18N2O3S — CID 2987046

IUPACN-(2,4-dimethylphenyl)morpholine-4-sulfonamide
SMILESCc1ccc(NS(=O)(=O)N2CCOCC2)c(C)c1
InChIInChI=1S/C12H18N2O3S/c1-10-3-4-12(11(2)9-10)13-18(15,16)14-5-7-17-8-6-14/h3-4,9,13H,5-8H2,1-2H3
InChIKeyUMWGHZGLEONTMG-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.29
Rot. Bonds3

About N-(2,4-dimethylphenyl)morpholine-4-sulfonamide

N-(2,4-dimethylphenyl)morpholine-4-sulfonamide (PubChem CID 2987046) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)morpholine-4-sulfonamide
PubChem CID2987046
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC NameN-(2,4-dimethylphenyl)morpholine-4-sulfonamide
SMILESCc1ccc(NS(=O)(=O)N2CCOCC2)c(C)c1
InChIInChI=1S/C12H18N2O3S/c1-10-3-4-12(11(2)9-10)13-18(15,16)14-5-7-17-8-6-14/h3-4,9,13H,5-8H2,1-2H3
InChIKeyUMWGHZGLEONTMG-UHFFFAOYSA-N
XLogP1.29
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(Morpholinomethyl)aniline
CID 776851
Mls002638339
CID 224941
N-(4-methylphenyl)morpholine-4-sulfonamide
CID 2979005
2-Cyclohex-1-enyl-4-morpholin-4-ylmethyl-phenylamine
CID 58994529
N-(2,4-dimethylphenyl)piperidine-1-sulfonamide
CID 2988699
2,6-Diisopropyl-4-morpholinomethylaniline
CID 13609084
2-(Morpholin-4-ylmethyl)aniline
CID 6484555
4-[1-(Morpholin-4-yl)ethyl]aniline
CID 50987527
2-(2-Aminophenyl)-1-morpholin-4-ylethanethione
CID 46887261
N-phenyl-4-morpholinesulfonamide
CID 4162887
[(Dimethylamino)sulfonyl](2,4-dimethylphenyl)amine
CID 4635398
2-methyl-5-(4-morpholinylmethyl)Benzenamine
CID 28596875

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)morpholine-4-sulfonamide?
The IUPAC name of N-(2,4-dimethylphenyl)morpholine-4-sulfonamide (CID 2987046) is N-(2,4-dimethylphenyl)morpholine-4-sulfonamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)morpholine-4-sulfonamide?
The canonical SMILES for N-(2,4-dimethylphenyl)morpholine-4-sulfonamide is Cc1ccc(NS(=O)(=O)N2CCOCC2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)morpholine-4-sulfonamide?
The InChIKey is UMWGHZGLEONTMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-10-3-4-12(11(2)9-10)13-18(15,16)14-5-7-17-8-6-14/h3-4,9,13H,5-8H2,1-2H3.
What are the key properties of N-(2,4-dimethylphenyl)morpholine-4-sulfonamide?
N-(2,4-dimethylphenyl)morpholine-4-sulfonamide has a molecular weight of 270.35 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)morpholine-4-sulfonamide is sourced from PubChem (CID 2987046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).