N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide

C16H21NO4S — CID 56792262

IUPACN-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide
SMILESCOCCN(Cc1ccco1)S(=O)(=O)Cc1cccc(C)c1
InChIInChI=1S/C16H21NO4S/c1-14-5-3-6-15(11-14)13-22(18,19)17(8-10-20-2)12-16-7-4-9-21-16/h3-7,9,11H,8,10,12-13H2,1-2H3
InChIKeyBXFLWOKGMDFSDB-UHFFFAOYSA-N
MW323.41 g/mol
LogP2.57
Rot. Bonds8

About N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide

N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide (PubChem CID 56792262) has the molecular formula C16H21NO4S and a molecular weight of 323.41 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide
PubChem CID56792262
Molecular FormulaC16H21NO4S
Molecular Weight323.41 g/mol
Exact Mass323.12
IUPAC NameN-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide
SMILESCOCCN(Cc1ccco1)S(=O)(=O)Cc1cccc(C)c1
InChIInChI=1S/C16H21NO4S/c1-14-5-3-6-15(11-14)13-22(18,19)17(8-10-20-2)12-16-7-4-9-21-16/h3-7,9,11H,8,10,12-13H2,1-2H3
InChIKeyBXFLWOKGMDFSDB-UHFFFAOYSA-N
XLogP2.57
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.41
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[furan-2-ylmethyl(methylsulfonyl)amino]ethyl]-2-(3-methylphenyl)acetamide
CID 113066497
2-[benzylsulfonyl(2-methoxyethyl)amino]-N-(furan-2-ylmethyl)-N-(2-phenylethyl)acetamide
CID 3911798
N-[2-(furan-2-yl)ethyl]-1-(3-methylphenyl)methanesulfonamide
CID 110733578
N-benzyl-N-(furan-2-ylmethyl)-2,5-dimethylbenzenesulfonamide
CID 2563703
N-(furan-2-ylmethyl)-2-(3-methylphenyl)acetamide
CID 6466784
2-methoxy-N-[(5-methylfuran-2-yl)methyl]-N-[(3-methylphenyl)methyl]ethanamine
CID 112842027
N-benzyl-N-(furan-2-ylmethyl)-2-[2-methoxyethyl-[(E)-2-phenylethenyl]sulfonylamino]acetamide
CID 42773241
2-(furan-2-yl)-N-[(3-methylphenyl)methyl]acetamide
CID 110690605
N-ethyl-1-(3-methylphenyl)-N-(2-pyridin-4-ylethyl)methanesulfonamide
CID 110755749
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-sulfonamide
CID 166223269
(E)-N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-3-(2,4,5-trimethylphenyl)prop-2-enamide
CID 60553181
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-3-(2,4,5-trimethylphenyl)prop-2-enamide
CID 76867605

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide (CID 56792262) is N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide is COCCN(Cc1ccco1)S(=O)(=O)Cc1cccc(C)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide?
The InChIKey is BXFLWOKGMDFSDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO4S/c1-14-5-3-6-15(11-14)13-22(18,19)17(8-10-20-2)12-16-7-4-9-21-16/h3-7,9,11H,8,10,12-13H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide?
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide has a molecular weight of 323.41 g/mol, XLogP of 2.57, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-1-(3-methylphenyl)methanesulfonamide is sourced from PubChem (CID 56792262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).