(2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol

C10H13F2NO — CID 130691213

IUPAC(2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol
SMILESCc1ccc(F)c([C@@](C)(N)CO)c1F
InChIInChI=1S/C10H13F2NO/c1-6-3-4-7(11)8(9(6)12)10(2,13)5-14/h3-4,14H,5,13H2,1-2H3/t10-/m0/s1
InChIKeyRJZHEBGBHAXZEX-JTQLQIEISA-N
MW201.22 g/mol
LogP1.44
Rot. Bonds2

About (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol

(2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol (PubChem CID 130691213) has the molecular formula C10H13F2NO and a molecular weight of 201.22 g/mol. Its IUPAC name is (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name(2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol
PubChem CID130691213
Molecular FormulaC10H13F2NO
Molecular Weight201.22 g/mol
Exact Mass201.10
IUPAC Name(2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol
SMILESCc1ccc(F)c([C@@](C)(N)CO)c1F
InChIInChI=1S/C10H13F2NO/c1-6-3-4-7(11)8(9(6)12)10(2,13)5-14/h3-4,14H,5,13H2,1-2H3/t10-/m0/s1
InChIKeyRJZHEBGBHAXZEX-JTQLQIEISA-N
XLogP1.44
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2R)-2-amino-1-hydroxypropan-2-yl]-3-fluoro-6-methylphenol
CID 130700380
2-amino-2-(2-fluoro-6-methylphenyl)propan-1-ol
CID 55294765
1-amino-2-(2,6-difluoro-3-methylphenyl)propan-2-ol
CID 82819317
1-(2,6-difluoro-3-methylphenyl)-1-(2-fluorophenyl)ethanamine
CID 82819787
2-amino-2-(2,6-difluoro-3-methylphenyl)-3,3,3-trifluoropropanoic acid
CID 82823247
1-(4-bromophenyl)-1-(2,6-difluoro-3-methylphenyl)ethanamine
CID 82820097
6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)-3-methylphenol
CID 117287928
2-(2,6-difluoro-3-methylphenyl)-4-methoxybutan-2-ol
CID 82819300
2-(2,6-difluoro-3-methylphenyl)-1-(ethylamino)propan-2-ol
CID 82828009
(2S)-2-amino-2-(2,6-difluoro-4-iodophenyl)propan-1-ol
CID 130690674
1-(2-bromophenyl)-1-(2,6-difluoro-3-methylphenyl)ethanamine
CID 82820253
(2R)-2-amino-2-(2-methoxy-6-methylphenyl)propan-1-ol
CID 55268996

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol?
The IUPAC name of (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol (CID 130691213) is (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol.
What is the SMILES notation for (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol?
The canonical SMILES for (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol is Cc1ccc(F)c([C@@](C)(N)CO)c1F.
What is the InChIKey of (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol?
The InChIKey is RJZHEBGBHAXZEX-JTQLQIEISA-N. The full InChI is InChI=1S/C10H13F2NO/c1-6-3-4-7(11)8(9(6)12)10(2,13)5-14/h3-4,14H,5,13H2,1-2H3/t10-/m0/s1.
What are the key properties of (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol?
(2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol has a molecular weight of 201.22 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(2,6-difluoro-3-methylphenyl)propan-1-ol is sourced from PubChem (CID 130691213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).