2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol

C14H15F2NO3 — CID 110888248

IUPAC2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol
SMILESOC(CNCc1ccccc1OC(F)F)c1ccco1
InChIInChI=1S/C14H15F2NO3/c15-14(16)20-12-5-2-1-4-10(12)8-17-9-11(18)13-6-3-7-19-13/h1-7,11,14,17-18H,8-9H2
InChIKeyQSGMCUCWMCCBSX-UHFFFAOYSA-N
MW283.27 g/mol
LogP2.70
Rot. Bonds7

About 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol

2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol (PubChem CID 110888248) has the molecular formula C14H15F2NO3 and a molecular weight of 283.27 g/mol. Its IUPAC name is 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol.

Molecular Properties

Compound Name2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol
PubChem CID110888248
Molecular FormulaC14H15F2NO3
Molecular Weight283.27 g/mol
Exact Mass283.10
IUPAC Name2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol
SMILESOC(CNCc1ccccc1OC(F)F)c1ccco1
InChIInChI=1S/C14H15F2NO3/c15-14(16)20-12-5-2-1-4-10(12)8-17-9-11(18)13-6-3-7-19-13/h1-7,11,14,17-18H,8-9H2
InChIKeyQSGMCUCWMCCBSX-UHFFFAOYSA-N
XLogP2.70
TPSA54.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.27
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-1-[[2-(difluoromethoxy)phenyl]methylamino]propan-2-ol
CID 93033134
1-(furan-2-yl)-2-[2-(2-methoxyphenyl)ethylamino]ethanol
CID 106261262
1-N-[[2-(difluoromethoxy)phenyl]methyl]-2-N,2-N-dimethylpropane-1,2-diamine
CID 54912949
2-[(2,5-dimethoxyphenyl)methylamino]-1-(furan-2-yl)ethanol
CID 110888253
N-[[2-(difluoromethoxy)phenyl]methyl]-2-ethoxypropan-1-amine
CID 115655473
2-cyclopropyl-N-[[2-(difluoromethoxy)phenyl]methyl]propan-1-amine
CID 115592704
1-cyclobutyl-N-[[2-(difluoromethoxy)phenyl]methyl]methanamine
CID 43298345
N-[[2-(difluoromethoxy)phenyl]methyl]-2-methylsulfinylpropan-1-amine
CID 115763988
1-[[2-(difluoromethoxy)phenyl]methylamino]-4-methylpentan-3-ol
CID 111468040
3-[[[2-(difluoromethoxy)phenyl]methylamino]methyl]oxolan-3-ol
CID 103848379
(2S)-1-[(2-propan-2-yloxyphenyl)methylamino]propan-2-ol
CID 51675528
N-[2-[[2-(difluoromethoxy)phenyl]methylamino]ethyl]-2-methylpropanamide
CID 28651324

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol?
The IUPAC name of 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol (CID 110888248) is 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol.
What is the SMILES notation for 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol?
The canonical SMILES for 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol is OC(CNCc1ccccc1OC(F)F)c1ccco1.
What is the InChIKey of 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol?
The InChIKey is QSGMCUCWMCCBSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2NO3/c15-14(16)20-12-5-2-1-4-10(12)8-17-9-11(18)13-6-3-7-19-13/h1-7,11,14,17-18H,8-9H2.
What are the key properties of 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol?
2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol has a molecular weight of 283.27 g/mol, XLogP of 2.70, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(difluoromethoxy)phenyl]methylamino]-1-(furan-2-yl)ethanol is sourced from PubChem (CID 110888248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).