N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide

C14H18N2O4S — CID 106003230

IUPACN-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide
SMILESCNCc1ccc(S(=O)(=O)Nc2ccccc2COC)o1
InChIInChI=1S/C14H18N2O4S/c1-15-9-12-7-8-14(20-12)21(17,18)16-13-6-4-3-5-11(13)10-19-2/h3-8,15-16H,9-10H2,1-2H3
InChIKeyDKONROAVOXZKHV-UHFFFAOYSA-N
MW310.38 g/mol
LogP1.95
Rot. Bonds7

About N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide

N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide (PubChem CID 106003230) has the molecular formula C14H18N2O4S and a molecular weight of 310.38 g/mol. Its IUPAC name is N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide
PubChem CID106003230
Molecular FormulaC14H18N2O4S
Molecular Weight310.38 g/mol
Exact Mass310.10
IUPAC NameN-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide
SMILESCNCc1ccc(S(=O)(=O)Nc2ccccc2COC)o1
InChIInChI=1S/C14H18N2O4S/c1-15-9-12-7-8-14(20-12)21(17,18)16-13-6-4-3-5-11(13)10-19-2/h3-8,15-16H,9-10H2,1-2H3
InChIKeyDKONROAVOXZKHV-UHFFFAOYSA-N
XLogP1.95
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bromo-3-methylphenyl)-5-(methylaminomethyl)furan-2-sulfonamide
CID 106073903
N-[2-(methoxymethyl)phenyl]-4-(methylaminomethyl)thiophene-2-sulfonamide
CID 106003238
5-(ethylaminomethyl)-N-(2-methoxyphenyl)furan-2-sulfonamide
CID 106045113
1-chloro-N-[2-(methoxymethyl)phenyl]methanesulfonamide
CID 63664132
N-[2-(methoxymethyl)phenyl]-2-(methylamino)pyrimidine-5-sulfonamide
CID 62151716
5-(methylaminomethyl)-N-thiophen-3-ylfuran-2-sulfonamide
CID 106070081
N-(2-fluoro-4-methylphenyl)-5-(methylaminomethyl)furan-2-sulfonamide
CID 106031076
2-bromo-N-[2-(methoxymethyl)phenyl]benzenesulfonamide
CID 47310105
N-[2-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 61249722
N-(5-bromo-2,4-difluorophenyl)-5-(methylaminomethyl)furan-2-sulfonamide
CID 106087052
N-[2-(methoxymethyl)phenyl]-3-(methylamino)propane-1-sulfonamide
CID 106003223
N-(4-chloro-3-methoxyphenyl)-5-(methylaminomethyl)furan-2-sulfonamide
CID 106087765

Frequently Asked Questions

What is the IUPAC name of N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide?
The IUPAC name of N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide (CID 106003230) is N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide.
What is the SMILES notation for N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide?
The canonical SMILES for N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide is CNCc1ccc(S(=O)(=O)Nc2ccccc2COC)o1.
What is the InChIKey of N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide?
The InChIKey is DKONROAVOXZKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4S/c1-15-9-12-7-8-14(20-12)21(17,18)16-13-6-4-3-5-11(13)10-19-2/h3-8,15-16H,9-10H2,1-2H3.
What are the key properties of N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide?
N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide has a molecular weight of 310.38 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methoxymethyl)phenyl]-5-(methylaminomethyl)furan-2-sulfonamide is sourced from PubChem (CID 106003230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).