ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine

C15H23F3N2O — CID 144655486

IUPACethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine
SMILESCC.Cc1ccnc(OC2CCN(CC(F)(F)F)CC2)c1
InChIInChI=1S/C13H17F3N2O.C2H6/c1-10-2-5-17-12(8-10)19-11-3-6-18(7-4-11)9-13(14,15)16;1-2/h2,5,8,11H,3-4,6-7,9H2,1H3;1-2H3
InChIKeyPLDPGPMBMYVNKB-UHFFFAOYSA-N
MW304.36 g/mol
LogP3.82
Rot. Bonds3

About ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine

ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine (PubChem CID 144655486) has the molecular formula C15H23F3N2O and a molecular weight of 304.36 g/mol. Its IUPAC name is ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine.

Molecular Properties

Compound Nameethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine
PubChem CID144655486
Molecular FormulaC15H23F3N2O
Molecular Weight304.36 g/mol
Exact Mass304.18
IUPAC Nameethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine
SMILESCC.Cc1ccnc(OC2CCN(CC(F)(F)F)CC2)c1
InChIInChI=1S/C13H17F3N2O.C2H6/c1-10-2-5-17-12(8-10)19-11-3-6-18(7-4-11)9-13(14,15)16;1-2/h2,5,8,11H,3-4,6-7,9H2,1H3;1-2H3
InChIKeyPLDPGPMBMYVNKB-UHFFFAOYSA-N
XLogP3.82
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.36
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine 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

5-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine
CID 75484484
2-cyclopentyloxy-4-methylpyridine
CID 18779821
4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine
CID 156719597
1-(3-methylpiperidin-1-yl)-2-[4-[(4-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethane-1,2-dione
CID 136536818
5-[4-[(4-methyl-2-pyridinyl)oxy]piperidin-1-yl]pyrazine-2-carboxylic acid
CID 122050962
4-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyridine;hydrochloride
CID 71638571
6-[1-[4-[(4-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethyl]-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine
CID 146287056
2-cyclobutyloxy-4-ethylpyridine
CID 118553785
4-[[4-(trifluoromethyl)-2-pyridinyl]oxy]piperidine-1-carbaldehyde
CID 175551989
N-[(3-methylphenyl)methyl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43768782
(6-cyclopentyloxy-3-pyridinyl)-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
CID 163346738
CID 156741568
CID 156741568

Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine?
The IUPAC name of ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine (CID 144655486) is ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine.
What is the SMILES notation for ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine?
The canonical SMILES for ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine is CC.Cc1ccnc(OC2CCN(CC(F)(F)F)CC2)c1.
What is the InChIKey of ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine?
The InChIKey is PLDPGPMBMYVNKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F3N2O.C2H6/c1-10-2-5-17-12(8-10)19-11-3-6-18(7-4-11)9-13(14,15)16;1-2/h2,5,8,11H,3-4,6-7,9H2,1H3;1-2H3.
What are the key properties of ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine?
ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine has a molecular weight of 304.36 g/mol, XLogP of 3.82, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine is sourced from PubChem (CID 144655486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).