(2-amino-3-fluorophenyl)-phenylmethanol

C13H12FNO — CID 105470844

IUPAC(2-amino-3-fluorophenyl)-phenylmethanol
SMILESNc1c(F)cccc1C(O)c1ccccc1
InChIInChI=1S/C13H12FNO/c14-11-8-4-7-10(12(11)15)13(16)9-5-2-1-3-6-9/h1-8,13,16H,15H2
InChIKeyRKLVOXIDANIXLM-UHFFFAOYSA-N
MW217.24 g/mol
LogP2.49
Rot. Bonds2

About (2-amino-3-fluorophenyl)-phenylmethanol

(2-amino-3-fluorophenyl)-phenylmethanol (PubChem CID 105470844) has the molecular formula C13H12FNO and a molecular weight of 217.24 g/mol. Its IUPAC name is (2-amino-3-fluorophenyl)-phenylmethanol.

Molecular Properties

Compound Name(2-amino-3-fluorophenyl)-phenylmethanol
PubChem CID105470844
Molecular FormulaC13H12FNO
Molecular Weight217.24 g/mol
Exact Mass217.09
IUPAC Name(2-amino-3-fluorophenyl)-phenylmethanol
SMILESNc1c(F)cccc1C(O)c1ccccc1
InChIInChI=1S/C13H12FNO/c14-11-8-4-7-10(12(11)15)13(16)9-5-2-1-3-6-9/h1-8,13,16H,15H2
InChIKeyRKLVOXIDANIXLM-UHFFFAOYSA-N
XLogP2.49
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.24
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(R)-[2-[(S)-hydroxy(phenyl)methyl]phenyl]-phenylmethanol
CID 92542463
2-[2-amino-3-[hydroxy(phenyl)methyl]phenyl]acetic acid;hydrate
CID 160922205
(2-amino-3-methylphenyl)-(2-fluorophenyl)methanol
CID 105489339
1-amino-1-(2-amino-3-fluorophenyl)propan-2-ol
CID 55293130
(R)-(2-amino-3-methoxyphenyl)-(2,6-difluorophenyl)methanol
CID 124565399
bis(2-fluorophenyl)methanol
CID 18424663
(S)-(2-fluorophenyl)-pyridin-4-ylmethanol
CID 166771520
2-amino-2-(2-amino-3-fluorophenyl)ethanol
CID 55283031
2-amino-1-(2,3-difluorophenyl)-2-phenylethanol
CID 63669574
(S)-[2-fluoro-3-(trifluoromethyl)phenyl]-phenylmethanol
CID 162539234
(R)-(3-amino-2-methylphenyl)-(4-phenylphenyl)methanol
CID 100804157
[4-(2-aminoethyl)phenyl]-(2-fluorophenyl)methanol
CID 82026510

Frequently Asked Questions

What is the IUPAC name of (2-amino-3-fluorophenyl)-phenylmethanol?
The IUPAC name of (2-amino-3-fluorophenyl)-phenylmethanol (CID 105470844) is (2-amino-3-fluorophenyl)-phenylmethanol.
What is the SMILES notation for (2-amino-3-fluorophenyl)-phenylmethanol?
The canonical SMILES for (2-amino-3-fluorophenyl)-phenylmethanol is Nc1c(F)cccc1C(O)c1ccccc1.
What is the InChIKey of (2-amino-3-fluorophenyl)-phenylmethanol?
The InChIKey is RKLVOXIDANIXLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO/c14-11-8-4-7-10(12(11)15)13(16)9-5-2-1-3-6-9/h1-8,13,16H,15H2.
What are the key properties of (2-amino-3-fluorophenyl)-phenylmethanol?
(2-amino-3-fluorophenyl)-phenylmethanol has a molecular weight of 217.24 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-fluorophenyl)-phenylmethanol is sourced from PubChem (CID 105470844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).