N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide

C10H18N2O3S — CID 102676052

IUPACN-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide
SMILESCNS(=O)(=O)CCNC(C)c1ccc(C)o1
InChIInChI=1S/C10H18N2O3S/c1-8-4-5-10(15-8)9(2)12-6-7-16(13,14)11-3/h4-5,9,11-12H,6-7H2,1-3H3
InChIKeyQTQIIWIRMWTXMS-UHFFFAOYSA-N
MW246.33 g/mol
LogP0.79
Rot. Bonds6

About N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide

N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide (PubChem CID 102676052) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide.

Molecular Properties

Compound NameN-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide
PubChem CID102676052
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC NameN-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide
SMILESCNS(=O)(=O)CCNC(C)c1ccc(C)o1
InChIInChI=1S/C10H18N2O3S/c1-8-4-5-10(15-8)9(2)12-6-7-16(13,14)11-3/h4-5,9,11-12H,6-7H2,1-3H3
InChIKeyQTQIIWIRMWTXMS-UHFFFAOYSA-N
XLogP0.79
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-[1-(5-methylfuran-2-yl)ethylamino]propane-1-sulfonamide
CID 75504665
3-ethylsulfonyl-N-[1-(5-methylfuran-2-yl)ethyl]propan-1-amine
CID 65092779
N-methyl-2-[1-(4-propan-2-ylphenyl)ethylamino]ethanesulfonamide
CID 102676134
1-bromo-N-[1-(5-methylfuran-2-yl)ethyl]methanesulfonamide
CID 83084663
N-methyl-2-(1-pyridin-4-ylethylamino)ethanesulfonamide
CID 102676244
N-methyl-2-[1-(3-methyl-1-benzofuran-2-yl)ethylamino]ethanesulfonamide
CID 102676059
4,4,4-trifluoro-N-[1-(5-methylfuran-2-yl)ethyl]butan-1-amine
CID 81344002
N-(2-ethoxyethyl)-1-(5-methylfuran-2-yl)ethanamine
CID 43403764
3-methyl-N-[1-(5-methylfuran-2-yl)ethyl]but-3-en-1-amine
CID 114449148
1-(5-methylfuran-2-yl)-N-[[1-(methylsulfonylmethyl)cyclopropyl]methyl]ethanamine
CID 75441574
4-(ethylamino)-N-[1-(5-methylfuran-2-yl)ethyl]butane-1-sulfonamide
CID 106003380
2-[1-(2,5-difluoro-4-methylphenyl)ethylamino]-N-methylethanesulfonamide
CID 106333847

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide?
The IUPAC name of N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide (CID 102676052) is N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide.
What is the SMILES notation for N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide?
The canonical SMILES for N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide is CNS(=O)(=O)CCNC(C)c1ccc(C)o1.
What is the InChIKey of N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide?
The InChIKey is QTQIIWIRMWTXMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c1-8-4-5-10(15-8)9(2)12-6-7-16(13,14)11-3/h4-5,9,11-12H,6-7H2,1-3H3.
What are the key properties of N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide?
N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide has a molecular weight of 246.33 g/mol, XLogP of 0.79, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(5-methylfuran-2-yl)ethylamino]ethanesulfonamide is sourced from PubChem (CID 102676052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).