N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide

C14H18N2O3S — CID 63085132

IUPACN-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide
SMILESCC(Cc1ccco1)Nc1ccccc1NS(C)(=O)=O
InChIInChI=1S/C14H18N2O3S/c1-11(10-12-6-5-9-19-12)15-13-7-3-4-8-14(13)16-20(2,17)18/h3-9,11,15-16H,10H2,1-2H3
InChIKeyXLRZUQGTUODKJG-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.69
Rot. Bonds6

About N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide

N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide (PubChem CID 63085132) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide
PubChem CID63085132
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC NameN-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide
SMILESCC(Cc1ccco1)Nc1ccccc1NS(C)(=O)=O
InChIInChI=1S/C14H18N2O3S/c1-11(10-12-6-5-9-19-12)15-13-7-3-4-8-14(13)16-20(2,17)18/h3-9,11,15-16H,10H2,1-2H3
InChIKeyXLRZUQGTUODKJG-UHFFFAOYSA-N
XLogP2.69
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(furan-2-yl)propan-2-yl]-2-methylsulfanylaniline
CID 63086307
3-[1-(furan-2-yl)propan-2-ylamino]-4-methylbenzenesulfonamide
CID 63085133
2,3-difluoro-N-[1-(furan-2-yl)propan-2-yl]aniline
CID 63085318
4-amino-3-[1-(furan-2-yl)propan-2-ylamino]benzenesulfonamide
CID 82907696
3-bromo-4-[1-(furan-2-yl)propan-2-ylamino]benzenesulfonamide
CID 63085665
1-(furan-2-yl)-N-[1-(furan-2-yl)propan-2-yl]propan-2-amine
CID 55179966
5-fluoro-N-[1-(furan-2-yl)propan-2-yl]-2-methylaniline
CID 63099917
N-[1-(furan-2-yl)propan-2-yl]-2-prop-2-enylsulfanylaniline
CID 63086016
5-amino-2-[1-(furan-2-yl)propan-2-ylamino]-N-methylbenzenesulfonamide
CID 103286859
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-methylsulfonylpropanamide
CID 94171682
N-[2-(3-methylpentan-2-ylamino)phenyl]methanesulfonamide
CID 43743986
N-[1-(furan-2-yl)propan-2-yl]-2-(1,2,4-triazol-1-yl)aniline
CID 63084439

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide?
The IUPAC name of N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide (CID 63085132) is N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide.
What is the SMILES notation for N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide?
The canonical SMILES for N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide is CC(Cc1ccco1)Nc1ccccc1NS(C)(=O)=O.
What is the InChIKey of N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide?
The InChIKey is XLRZUQGTUODKJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-11(10-12-6-5-9-19-12)15-13-7-3-4-8-14(13)16-20(2,17)18/h3-9,11,15-16H,10H2,1-2H3.
What are the key properties of N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide?
N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide has a molecular weight of 294.38 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(furan-2-yl)propan-2-ylamino]phenyl]methanesulfonamide is sourced from PubChem (CID 63085132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).