[methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol

C10H12F3NO2 — CID 162547672

IUPAC[methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol
SMILESCON(C)C(O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C10H12F3NO2/c1-14(16-2)9(15)7-4-3-5-8(6-7)10(11,12)13/h3-6,9,15H,1-2H3
InChIKeyUYDFYZUZQWJGKO-UHFFFAOYSA-N
MW235.20 g/mol
LogP2.19
Rot. Bonds3

About [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol

[methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol (PubChem CID 162547672) has the molecular formula C10H12F3NO2 and a molecular weight of 235.20 g/mol. Its IUPAC name is [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name[methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol
PubChem CID162547672
Molecular FormulaC10H12F3NO2
Molecular Weight235.20 g/mol
Exact Mass235.08
IUPAC Name[methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol
SMILESCON(C)C(O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C10H12F3NO2/c1-14(16-2)9(15)7-4-3-5-8(6-7)10(11,12)13/h3-6,9,15H,1-2H3
InChIKeyUYDFYZUZQWJGKO-UHFFFAOYSA-N
XLogP2.19
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.20
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(dimethylamino)-1-[3-(trifluoromethyl)phenyl]ethanol
CID 60981029
2-methoxy-3-methyl-1-[3-(trifluoromethyl)phenyl]butan-1-ol
CID 116712081
O-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]hydroxylamine
CID 10899748
(1S,2S)-1-amino-1-[3-(trifluoromethyl)phenyl]propan-2-ol
CID 129052960
2,2,3,3,3-pentafluoro-1-[3-(trifluoromethyl)phenyl]propan-1-ol
CID 162511327
(4-methylphenyl)-[3-(trifluoromethyl)phenyl]methanol
CID 60799413
3-methyl-1-[3-(trifluoromethyl)phenyl]but-2-en-1-ol
CID 59652784
4-[3-(trifluoromethyl)phenyl]pentan-2-ol
CID 64718997
1-(2-bromo-1-methoxyethyl)-3-(trifluoromethyl)benzene
CID 10589008
pyridin-4-yl-[3-(trifluoromethyl)phenyl]methanol
CID 11425288
2-methylsulfanyl-1-[3-(trifluoromethyl)phenyl]ethanol
CID 62791843
3,3-dimethyl-1-[3-(trifluoromethyl)phenyl]butan-1-ol
CID 63890426

Frequently Asked Questions

What is the IUPAC name of [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol?
The IUPAC name of [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol (CID 162547672) is [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol is CON(C)C(O)c1cccc(C(F)(F)F)c1.
What is the InChIKey of [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol?
The InChIKey is UYDFYZUZQWJGKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO2/c1-14(16-2)9(15)7-4-3-5-8(6-7)10(11,12)13/h3-6,9,15H,1-2H3.
What are the key properties of [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol?
[methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol has a molecular weight of 235.20 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [methoxy(methyl)amino]-[3-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 162547672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).