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

C14H13F3N2O — CID 79794361

IUPAC6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
SMILESOc1ccc(CNCc2ccc(C(F)(F)F)cc2)nc1
InChIInChI=1S/C14H13F3N2O/c15-14(16,17)11-3-1-10(2-4-11)7-18-8-12-5-6-13(20)9-19-12/h1-6,9,18,20H,7-8H2
InChIKeyGCQRJKQXZSKPCM-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.10
Rot. Bonds4

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

6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol (PubChem CID 79794361) has the molecular formula C14H13F3N2O and a molecular weight of 282.27 g/mol. Its IUPAC name is 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
PubChem CID79794361
Molecular FormulaC14H13F3N2O
Molecular Weight282.27 g/mol
Exact Mass282.10
IUPAC Name6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
SMILESOc1ccc(CNCc2ccc(C(F)(F)F)cc2)nc1
InChIInChI=1S/C14H13F3N2O/c15-14(16,17)11-3-1-10(2-4-11)7-18-8-12-5-6-13(20)9-19-12/h1-6,9,18,20H,7-8H2
InChIKeyGCQRJKQXZSKPCM-UHFFFAOYSA-N
XLogP3.10
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(trifluoromethyl)phenyl]-N-[[4-(trifluoromethyl)phenyl]methyl]methanamine
CID 594666
6-[(3,3,3-trifluoropropylamino)methyl]pyridin-3-ol
CID 79793918
1-[4-(trifluoromethyl)phenyl]-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]methanamine
CID 169111944
N-[(4-chlorophenyl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 29042343
6-[(1,3-thiazol-4-ylmethylamino)methyl]pyridin-3-ol
CID 79794983
N-(1H-pyrazol-4-ylmethyl)-1-[4-(trifluoromethyl)phenyl]methanamine
CID 54897039
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 60702122
N-[(6-methoxy-3-pyridinyl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 28712185
6-methyl-2-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol
CID 78928434
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 60702101
N-[(5-methyl-3-pyridinyl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 103864336
N-[(4-hydroxyphenyl)methyl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115577921

Frequently Asked Questions

What is the IUPAC name of 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
The IUPAC name of 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol (CID 79794361) is 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
The canonical SMILES for 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol is Oc1ccc(CNCc2ccc(C(F)(F)F)cc2)nc1.
What is the InChIKey of 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
The InChIKey is GCQRJKQXZSKPCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O/c15-14(16,17)11-3-1-10(2-4-11)7-18-8-12-5-6-13(20)9-19-12/h1-6,9,18,20H,7-8H2.
What are the key properties of 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol?
6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol has a molecular weight of 282.27 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[[4-(trifluoromethyl)phenyl]methylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 79794361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).