(R)-amino-[4-(difluoromethoxy)phenyl]methanol

C8H9F2NO2 — CID 131969253

IUPAC(R)-amino-[4-(difluoromethoxy)phenyl]methanol
SMILESN[C@H](O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C8H9F2NO2/c9-8(10)13-6-3-1-5(2-4-6)7(11)12/h1-4,7-8,12H,11H2/t7-/m1/s1
InChIKeyJDUHNGQVATZAKN-SSDOTTSWSA-N
MW189.16 g/mol
LogP1.24
Rot. Bonds3

About (R)-amino-[4-(difluoromethoxy)phenyl]methanol

(R)-amino-[4-(difluoromethoxy)phenyl]methanol (PubChem CID 131969253) has the molecular formula C8H9F2NO2 and a molecular weight of 189.16 g/mol. Its IUPAC name is (R)-amino-[4-(difluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Name(R)-amino-[4-(difluoromethoxy)phenyl]methanol
PubChem CID131969253
Molecular FormulaC8H9F2NO2
Molecular Weight189.16 g/mol
Exact Mass189.06
IUPAC Name(R)-amino-[4-(difluoromethoxy)phenyl]methanol
SMILESN[C@H](O)c1ccc(OC(F)F)cc1
InChIInChI=1S/C8H9F2NO2/c9-8(10)13-6-3-1-5(2-4-6)7(11)12/h1-4,7-8,12H,11H2/t7-/m1/s1
InChIKeyJDUHNGQVATZAKN-SSDOTTSWSA-N
XLogP1.24
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.16
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(2S,3S)-3-amino-3-[4-(difluoromethoxy)phenyl]-1,1,1-trifluoropropan-2-ol;hydrochloride
CID 171268477
(1S,2R)-2-amino-1-[4-(difluoromethoxy)phenyl]propan-1-ol
CID 28743825
(4-chlorophenyl)-[4-(difluoromethoxy)phenyl]methanamine
CID 4961731
methyl (2R)-2-amino-2-[4-(difluoromethoxy)phenyl]acetate
CID 93311120
(1R,2S)-2-amino-1-cyclohexyl-2-[4-(difluoromethoxy)phenyl]ethanol;hydrochloride
CID 171268471
(3S)-3-amino-3-[4-(difluoromethoxy)phenyl]propanamide
CID 29059969
(3S)-3-amino-3-[4-(difluoromethoxy)phenyl]-2,2-difluoropropan-1-ol
CID 171248414
4-(difluoromethoxy)aniline
CID 737363
3-[4-(difluoromethoxy)phenyl]-2-fluoro-3-hydroxypropanoic acid
CID 79366363
2-(aminomethyl)-1-[4-(difluoromethoxy)phenyl]butan-1-ol
CID 79135604
4-amino-4-[4-(difluoromethoxy)phenyl]butanoic acid
CID 117364214
4-chloro-1-[4-(difluoromethoxy)phenyl]butane-1,2-diol
CID 171894158

Frequently Asked Questions

What is the IUPAC name of (R)-amino-[4-(difluoromethoxy)phenyl]methanol?
The IUPAC name of (R)-amino-[4-(difluoromethoxy)phenyl]methanol (CID 131969253) is (R)-amino-[4-(difluoromethoxy)phenyl]methanol.
What is the SMILES notation for (R)-amino-[4-(difluoromethoxy)phenyl]methanol?
The canonical SMILES for (R)-amino-[4-(difluoromethoxy)phenyl]methanol is N[C@H](O)c1ccc(OC(F)F)cc1.
What is the InChIKey of (R)-amino-[4-(difluoromethoxy)phenyl]methanol?
The InChIKey is JDUHNGQVATZAKN-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H9F2NO2/c9-8(10)13-6-3-1-5(2-4-6)7(11)12/h1-4,7-8,12H,11H2/t7-/m1/s1.
What are the key properties of (R)-amino-[4-(difluoromethoxy)phenyl]methanol?
(R)-amino-[4-(difluoromethoxy)phenyl]methanol has a molecular weight of 189.16 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-amino-[4-(difluoromethoxy)phenyl]methanol is sourced from PubChem (CID 131969253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).