N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide

C15H19NO3S — CID 121127099

IUPACN-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide
SMILESCc1cccc(CS(=O)(=O)NC(C)Cc2ccoc2)c1
InChIInChI=1S/C15H19NO3S/c1-12-4-3-5-15(8-12)11-20(17,18)16-13(2)9-14-6-7-19-10-14/h3-8,10,13,16H,9,11H2,1-2H3
InChIKeyFRQYVQOYTHMMAM-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.64
Rot. Bonds6

About N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide

N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide (PubChem CID 121127099) has the molecular formula C15H19NO3S and a molecular weight of 293.39 g/mol. Its IUPAC name is N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide
PubChem CID121127099
Molecular FormulaC15H19NO3S
Molecular Weight293.39 g/mol
Exact Mass293.11
IUPAC NameN-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide
SMILESCc1cccc(CS(=O)(=O)NC(C)Cc2ccoc2)c1
InChIInChI=1S/C15H19NO3S/c1-12-4-3-5-15(8-12)11-20(17,18)16-13(2)9-14-6-7-19-10-14/h3-8,10,13,16H,9,11H2,1-2H3
InChIKeyFRQYVQOYTHMMAM-UHFFFAOYSA-N
XLogP2.64
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(furan-3-yl)propan-2-yl]-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

1-(3-fluorophenyl)-N-[(2R)-1-(furan-3-yl)propan-2-yl]methanesulfonamide
CID 99873201
1-(3,5-difluorophenyl)-N-[1-(furan-3-yl)propan-2-yl]methanesulfonamide
CID 121127157
N-(2,4-dimethylpentan-3-yl)-1-(3-methylphenyl)methanesulfonamide
CID 27210808
1-(3-methylphenyl)-N-[(1S)-1-phenylethyl]methanesulfonamide
CID 27210154
1-(furan-3-yl)-3-(3-methylphenyl)-N-propylpropan-2-amine
CID 83175808
N-(furan-3-ylmethyl)-4-(3-methylphenyl)butan-2-amine
CID 115711448
N-[(2S)-1-(furan-3-yl)propan-2-yl]-2-(4-methoxyphenyl)ethanesulfonamide
CID 99873213
1-(furan-3-yl)-4-(3-methylphenyl)butan-2-amine
CID 105177799
[1-(furan-3-yl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105331898
2,4-dichloro-N-[(2S)-1-(furan-3-yl)propan-2-yl]-5-methylbenzenesulfonamide
CID 99873228
2-(furan-3-yl)-1-(3-methylphenyl)ethanol
CID 83171478
1-(3-methylphenyl)-N-[(1S)-1-(5-methylsulfonyl-1,3,4-oxadiazol-2-yl)ethyl]methanesulfonamide
CID 9186143

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide?
The IUPAC name of N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide (CID 121127099) is N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide.
What is the SMILES notation for N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide?
The canonical SMILES for N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide is Cc1cccc(CS(=O)(=O)NC(C)Cc2ccoc2)c1.
What is the InChIKey of N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide?
The InChIKey is FRQYVQOYTHMMAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3S/c1-12-4-3-5-15(8-12)11-20(17,18)16-13(2)9-14-6-7-19-10-14/h3-8,10,13,16H,9,11H2,1-2H3.
What are the key properties of N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide?
N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide has a molecular weight of 293.39 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-3-yl)propan-2-yl]-1-(3-methylphenyl)methanesulfonamide is sourced from PubChem (CID 121127099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).