6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol

C15H15F3N2O — CID 78928434

IUPAC6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CNCc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C15H15F3N2O/c1-10-2-7-14(21)13(20-10)9-19-8-11-3-5-12(6-4-11)15(16,17)18/h2-7,19,21H,8-9H2,1H3
InChIKeyQKSUSDJJGNSYPZ-UHFFFAOYSA-N
MW296.29 g/mol
LogP3.40
Rot. Bonds4

About 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol

6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol (PubChem CID 78928434) has the molecular formula C15H15F3N2O and a molecular weight of 296.29 g/mol. Its IUPAC name is 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
PubChem CID78928434
Molecular FormulaC15H15F3N2O
Molecular Weight296.29 g/mol
Exact Mass296.11
IUPAC Name6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CNCc2ccc(C(F)(F)F)cc2)n1
InChIInChI=1S/C15H15F3N2O/c1-10-2-7-14(21)13(20-10)9-19-8-11-3-5-12(6-4-11)15(16,17)18/h2-7,19,21H,8-9H2,1H3
InChIKeyQKSUSDJJGNSYPZ-UHFFFAOYSA-N
XLogP3.40
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.29
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(4-bromophenyl)methylamino]methyl]-6-methylpyridin-3-ol
CID 78928746
1-[4-(trifluoromethyl)phenyl]-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine
CID 594666
6-methyl-2-[[(3-methylphenyl)methylamino]methyl]pyridin-3-ol
CID 78928518
2-[(2-hydroxyethylamino)methyl]-6-methylpyridin-3-ol
CID 78967327
6-methyl-2-[[(2-methylphenyl)methylamino]methyl]pyridin-3-ol
CID 78928537
N-[(4-methylsulfanylphenyl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 60699641
2-[(2-bromoprop-2-enylamino)methyl]-6-methylpyridin-3-ol
CID 115614759
N-[(5-methyl-3-pyridinyl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 103864336
3-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]propanoic acid
CID 79163527
6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
CID 79794361
N-[(4-chlorophenyl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 29042343
6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol
CID 78943653

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
The IUPAC name of 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol (CID 78928434) is 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
The canonical SMILES for 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol is Cc1ccc(O)c(CNCc2ccc(C(F)(F)F)cc2)n1.
What is the InChIKey of 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
The InChIKey is QKSUSDJJGNSYPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N2O/c1-10-2-7-14(21)13(20-10)9-19-8-11-3-5-12(6-4-11)15(16,17)18/h2-7,19,21H,8-9H2,1H3.
What are the key properties of 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol has a molecular weight of 296.29 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 78928434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).