(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol

C14H14FNO — CID 105489348

IUPAC(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol
SMILESCc1ccc(N)c(C(O)c2cccc(F)c2)c1
InChIInChI=1S/C14H14FNO/c1-9-5-6-13(16)12(7-9)14(17)10-3-2-4-11(15)8-10/h2-8,14,17H,16H2,1H3
InChIKeyRUAIBDNJFSVSKT-UHFFFAOYSA-N
MW231.27 g/mol
LogP2.80
Rot. Bonds2

About (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol

(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol (PubChem CID 105489348) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol.

Molecular Properties

Compound Name(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol
PubChem CID105489348
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol
SMILESCc1ccc(N)c(C(O)c2cccc(F)c2)c1
InChIInChI=1S/C14H14FNO/c1-9-5-6-13(16)12(7-9)14(17)10-3-2-4-11(15)8-10/h2-8,14,17H,16H2,1H3
InChIKeyRUAIBDNJFSVSKT-UHFFFAOYSA-N
XLogP2.80
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 52.80
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

3-[(2-amino-5-methylphenyl)-hydroxymethyl]phenol
CID 105486551
(2-fluoro-4-methylphenyl)-(3-fluorophenyl)methanol
CID 114978479
(2-amino-5-methylphenyl)-(4-methylphenyl)methanol
CID 105484727
(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol
CID 62301823
(2-amino-5-fluorophenyl)-(3-ethylphenyl)methanol
CID 82684554
(2-fluoro-3-methylphenyl)-(3-fluorophenyl)methanol
CID 114978614
(2-amino-5-fluorophenyl)-(2,4-dimethylphenyl)methanol
CID 82684351
(2-amino-4-chlorophenyl)-(3-fluorophenyl)methanol
CID 64915603
(4-fluoro-2-methylphenyl)-(3-methylphenyl)methanol
CID 62791652
[3-(difluoromethyl)phenyl]-(2-fluoro-5-methylphenyl)methanol
CID 115527738
3-amino-1-(2,5-dimethylphenyl)-2-(3-fluorophenyl)propan-1-ol
CID 65190697
(4-fluoro-3,5-dimethylphenyl)-(3-fluorophenyl)methanol
CID 65296831

Frequently Asked Questions

What is the IUPAC name of (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol?
The IUPAC name of (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol (CID 105489348) is (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol.
What is the SMILES notation for (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol?
The canonical SMILES for (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol is Cc1ccc(N)c(C(O)c2cccc(F)c2)c1.
What is the InChIKey of (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol?
The InChIKey is RUAIBDNJFSVSKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c1-9-5-6-13(16)12(7-9)14(17)10-3-2-4-11(15)8-10/h2-8,14,17H,16H2,1H3.
What are the key properties of (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol?
(2-amino-5-methylphenyl)-(3-fluorophenyl)methanol has a molecular weight of 231.27 g/mol, XLogP of 2.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-methylphenyl)-(3-fluorophenyl)methanol is sourced from PubChem (CID 105489348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).