[4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol

C11H14F3N3O2 — CID 106747936

IUPAC[4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol
SMILESNc1cnc(C(F)(F)F)cc1N1CCOC(CO)C1
InChIInChI=1S/C11H14F3N3O2/c12-11(13,14)10-3-9(8(15)4-16-10)17-1-2-19-7(5-17)6-18/h3-4,7,18H,1-2,5-6,15H2
InChIKeyMUNBDNFGNJOTGY-UHFFFAOYSA-N
MW277.25 g/mol
LogP0.88
Rot. Bonds2

About [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol

[4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol (PubChem CID 106747936) has the molecular formula C11H14F3N3O2 and a molecular weight of 277.25 g/mol. Its IUPAC name is [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol
PubChem CID106747936
Molecular FormulaC11H14F3N3O2
Molecular Weight277.25 g/mol
Exact Mass277.10
IUPAC Name[4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol
SMILESNc1cnc(C(F)(F)F)cc1N1CCOC(CO)C1
InChIInChI=1S/C11H14F3N3O2/c12-11(13,14)10-3-9(8(15)4-16-10)17-1-2-19-7(5-17)6-18/h3-4,7,18H,1-2,5-6,15H2
InChIKeyMUNBDNFGNJOTGY-UHFFFAOYSA-N
XLogP0.88
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.25
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol (CID 106747936) is [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol is Nc1cnc(C(F)(F)F)cc1N1CCOC(CO)C1.
What is the InChIKey of [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol?
The InChIKey is MUNBDNFGNJOTGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O2/c12-11(13,14)10-3-9(8(15)4-16-10)17-1-2-19-7(5-17)6-18/h3-4,7,18H,1-2,5-6,15H2.
What are the key properties of [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol?
[4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol has a molecular weight of 277.25 g/mol, XLogP of 0.88, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[5-amino-2-(trifluoromethyl)-4-pyridinyl]morpholin-2-yl]methanol is sourced from PubChem (CID 106747936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).