2-anilino-2-(2,6-difluorophenyl)propan-1-ol

C15H15F2NO — CID 61046430

IUPAC2-anilino-2-(2,6-difluorophenyl)propan-1-ol
SMILESCC(CO)(Nc1ccccc1)c1c(F)cccc1F
InChIInChI=1S/C15H15F2NO/c1-15(10-19,18-11-6-3-2-4-7-11)14-12(16)8-5-9-13(14)17/h2-9,18-19H,10H2,1H3
InChIKeyHMDMRJGUWMVFAY-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.28
Rot. Bonds4

About 2-anilino-2-(2,6-difluorophenyl)propan-1-ol

2-anilino-2-(2,6-difluorophenyl)propan-1-ol (PubChem CID 61046430) has the molecular formula C15H15F2NO and a molecular weight of 263.29 g/mol. Its IUPAC name is 2-anilino-2-(2,6-difluorophenyl)propan-1-ol.

Molecular Properties

Compound Name2-anilino-2-(2,6-difluorophenyl)propan-1-ol
PubChem CID61046430
Molecular FormulaC15H15F2NO
Molecular Weight263.29 g/mol
Exact Mass263.11
IUPAC Name2-anilino-2-(2,6-difluorophenyl)propan-1-ol
SMILESCC(CO)(Nc1ccccc1)c1c(F)cccc1F
InChIInChI=1S/C15H15F2NO/c1-15(10-19,18-11-6-3-2-4-7-11)14-12(16)8-5-9-13(14)17/h2-9,18-19H,10H2,1H3
InChIKeyHMDMRJGUWMVFAY-UHFFFAOYSA-N
XLogP3.28
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-difluorophenyl)-2-(2-fluoroanilino)propan-1-ol
CID 61049920
2-(2-chloroanilino)-2-(2,6-difluorophenyl)propan-1-ol
CID 61049935
2-(4-fluoroanilino)-2-(2-fluorophenyl)propan-1-ol
CID 61048560
2-(2,6-difluorophenyl)-2-(propylamino)propan-1-ol
CID 61053956
2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol
CID 61047955
2-(4-fluoroanilino)-2-(2,4,6-trimethylphenyl)propan-1-ol
CID 61048556
2,6-difluoro-N-(1-hydroxy-2-phenylpropan-2-yl)benzamide
CID 105058990
2-(3-chloroanilino)-2-(2,5-difluorophenyl)propan-1-ol
CID 61047742
2-anilino-2-(4-propan-2-yloxyphenyl)propan-1-ol
CID 61046598
2-(benzylamino)-2-(2-fluorophenyl)propan-1-ol
CID 61046917
2-(4-bromophenyl)-2-(3-fluoroanilino)propan-1-ol
CID 61048694
2-(3,4-dimethylphenyl)-2-(3-fluoroanilino)propan-1-ol
CID 61047714

Frequently Asked Questions

What is the IUPAC name of 2-anilino-2-(2,6-difluorophenyl)propan-1-ol?
The IUPAC name of 2-anilino-2-(2,6-difluorophenyl)propan-1-ol (CID 61046430) is 2-anilino-2-(2,6-difluorophenyl)propan-1-ol.
What is the SMILES notation for 2-anilino-2-(2,6-difluorophenyl)propan-1-ol?
The canonical SMILES for 2-anilino-2-(2,6-difluorophenyl)propan-1-ol is CC(CO)(Nc1ccccc1)c1c(F)cccc1F.
What is the InChIKey of 2-anilino-2-(2,6-difluorophenyl)propan-1-ol?
The InChIKey is HMDMRJGUWMVFAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO/c1-15(10-19,18-11-6-3-2-4-7-11)14-12(16)8-5-9-13(14)17/h2-9,18-19H,10H2,1H3.
What are the key properties of 2-anilino-2-(2,6-difluorophenyl)propan-1-ol?
2-anilino-2-(2,6-difluorophenyl)propan-1-ol has a molecular weight of 263.29 g/mol, XLogP of 3.28, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2-(2,6-difluorophenyl)propan-1-ol is sourced from PubChem (CID 61046430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).