1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol

C11H15F2NO — CID 63933107

IUPAC1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol
SMILESCC(C)(O)CNCc1c(F)cccc1F
InChIInChI=1S/C11H15F2NO/c1-11(2,15)7-14-6-8-9(12)4-3-5-10(8)13/h3-5,14-15H,6-7H2,1-2H3
InChIKeyDASHRPXCFOYUJM-UHFFFAOYSA-N
MW215.24 g/mol
LogP1.83
Rot. Bonds4

About 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol

1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol (PubChem CID 63933107) has the molecular formula C11H15F2NO and a molecular weight of 215.24 g/mol. Its IUPAC name is 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol
PubChem CID63933107
Molecular FormulaC11H15F2NO
Molecular Weight215.24 g/mol
Exact Mass215.11
IUPAC Name1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol
SMILESCC(C)(O)CNCc1c(F)cccc1F
InChIInChI=1S/C11H15F2NO/c1-11(2,15)7-14-6-8-9(12)4-3-5-10(8)13/h3-5,14-15H,6-7H2,1-2H3
InChIKeyDASHRPXCFOYUJM-UHFFFAOYSA-N
XLogP1.83
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.24
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-chloro-3-fluorophenyl)methylamino]-2-methylpropan-2-ol
CID 112652111
N'-tert-butyl-N-[(2,6-difluorophenyl)methyl]ethane-1,2-diamine
CID 113405352
tert-butyl N-[3-[(2,6-difluorophenyl)methylamino]-2,2-difluoropropyl]carbamate
CID 104954072
1-[(2-fluoro-3-methoxyphenyl)methylamino]-2-methylpropan-2-ol
CID 104791866
N-[(2-chloro-6-fluorophenyl)methyl]-2-methoxy-2-methylpropan-1-amine
CID 115656308
2-methyl-1-[(2,3,6-trichlorophenyl)methylamino]propan-2-ol
CID 78954209
N-chloro-1-(2,6-difluorophenyl)methanamine
CID 126658076
1-[[(2-hydroxy-2-methylpropyl)amino]methyl]naphthalen-2-ol
CID 63933523
1-[(4-chlorophenyl)methylamino]-2-methylpropan-2-ol
CID 60885282
1-[(4-tert-butyl-2,6-dimethylphenyl)methylamino]-2-methylpropan-2-ol
CID 96666593
(2S)-4-[(2,6-difluorophenyl)methylamino]butan-2-ol
CID 96500088
1-[[3-(hydroxymethyl)phenyl]methylamino]-2-methylpropan-2-ol
CID 107230534

Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol?
The IUPAC name of 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol (CID 63933107) is 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol is CC(C)(O)CNCc1c(F)cccc1F.
What is the InChIKey of 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol?
The InChIKey is DASHRPXCFOYUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NO/c1-11(2,15)7-14-6-8-9(12)4-3-5-10(8)13/h3-5,14-15H,6-7H2,1-2H3.
What are the key properties of 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol?
1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol has a molecular weight of 215.24 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-difluorophenyl)methylamino]-2-methylpropan-2-ol is sourced from PubChem (CID 63933107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).