2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol

C11H17F3N2O — CID 141299351

IUPAC2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
SMILESCC1=CC=C(O)C(CN(C)C)N1CC(F)(F)F
InChIInChI=1S/C11H17F3N2O/c1-8-4-5-10(17)9(6-15(2)3)16(8)7-11(12,13)14/h4-5,9,17H,6-7H2,1-3H3
InChIKeyPQVLHQXGKNUNOO-UHFFFAOYSA-N
MW250.26 g/mol
LogP2.14
Rot. Bonds3

About 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol

2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol (PubChem CID 141299351) has the molecular formula C11H17F3N2O and a molecular weight of 250.26 g/mol. Its IUPAC name is 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol.

Molecular Properties

Compound Name2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
PubChem CID141299351
Molecular FormulaC11H17F3N2O
Molecular Weight250.26 g/mol
Exact Mass250.13
IUPAC Name2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
SMILESCC1=CC=C(O)C(CN(C)C)N1CC(F)(F)F
InChIInChI=1S/C11H17F3N2O/c1-8-4-5-10(17)9(6-15(2)3)16(8)7-11(12,13)14/h4-5,9,17H,6-7H2,1-3H3
InChIKeyPQVLHQXGKNUNOO-UHFFFAOYSA-N
XLogP2.14
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-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

6-(difluoromethyl)-2-ethyl-1-methyl-2H-pyridin-3-ol
CID 141220732
6-(difluoromethyl)-1,2-dimethyl-2H-pyridin-3-ol
CID 141220741
1,2-dimethyl-6-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
CID 141220747
2-[(dimethylamino)methyl]-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol
CID 141299345
1-(2,2-difluoroethyl)-2-[(dimethylamino)methyl]-6-methyl-2H-pyridin-3-ol
CID 141299363
1-methyl-2-[2,2,2-trifluoro-1-(4-methylpiperazin-1-yl)ethyl]-2H-pyridin-3-ol
CID 141299369

Frequently Asked Questions

What is the IUPAC name of 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol?
The IUPAC name of 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol (CID 141299351) is 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol.
What is the SMILES notation for 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol?
The canonical SMILES for 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol is CC1=CC=C(O)C(CN(C)C)N1CC(F)(F)F.
What is the InChIKey of 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol?
The InChIKey is PQVLHQXGKNUNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N2O/c1-8-4-5-10(17)9(6-15(2)3)16(8)7-11(12,13)14/h4-5,9,17H,6-7H2,1-3H3.
What are the key properties of 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol?
2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol has a molecular weight of 250.26 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dimethylamino)methyl]-6-methyl-1-(2,2,2-trifluoroethyl)-2H-pyridin-3-ol is sourced from PubChem (CID 141299351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).