2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol

C13H20FN3O — CID 131891058

IUPAC2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol
SMILESOCCN1CCC(CNc2ncccc2F)CC1
InChIInChI=1S/C13H20FN3O/c14-12-2-1-5-15-13(12)16-10-11-3-6-17(7-4-11)8-9-18/h1-2,5,11,18H,3-4,6-10H2,(H,15,16)
InChIKeyWIVFBORGROMTDT-UHFFFAOYSA-N
MW253.32 g/mol
LogP1.34
Rot. Bonds5

About 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol

2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol (PubChem CID 131891058) has the molecular formula C13H20FN3O and a molecular weight of 253.32 g/mol. Its IUPAC name is 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol
PubChem CID131891058
Molecular FormulaC13H20FN3O
Molecular Weight253.32 g/mol
Exact Mass253.16
IUPAC Name2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol
SMILESOCCN1CCC(CNc2ncccc2F)CC1
InChIInChI=1S/C13H20FN3O/c14-12-2-1-5-15-13(12)16-10-11-3-6-17(7-4-11)8-9-18/h1-2,5,11,18H,3-4,6-10H2,(H,15,16)
InChIKeyWIVFBORGROMTDT-UHFFFAOYSA-N
XLogP1.34
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol 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

3-fluoro-N-(piperidin-4-ylmethyl)pyridin-2-amine;dihydrochloride
CID 162422902
3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine
CID 62734731
2-[4-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]piperidin-1-yl]ethanol
CID 133470345
tert-butyl (3S)-3-[[(3-fluoro-2-pyridinyl)amino]methyl]pyrrolidine-1-carboxylate
CID 99857975
N-[[1-(3-fluoro-2-pyridinyl)piperidin-4-yl]methyl]ethanamine
CID 55111529
methyl 2-[(1-ethylpyrrolidin-3-yl)methylamino]pyridine-3-carboxylate
CID 62000868
1-(2,6-difluorophenyl)-N-[[1-(2-hydroxyethyl)piperidin-4-yl]methyl]-4-methylpyrazole-3-carboxamide
CID 119044683
2-[4-[[(2-thiophen-2-ylquinazolin-4-yl)amino]methyl]piperidin-1-yl]ethanol
CID 133281392
2-[4-[(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylamino)methyl]piperidin-1-yl]ethanol
CID 133281344
2-[4-[(2-hydrazinyl-3-pyridinyl)methyl]piperazin-1-yl]ethanol
CID 62470861
2-[4-[[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol
CID 133281384
formic acid;2-[4-(isoquinolin-1-ylamino)piperidin-1-yl]ethanol
CID 154914907

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol?
The IUPAC name of 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol (CID 131891058) is 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol.
What is the SMILES notation for 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol?
The canonical SMILES for 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol is OCCN1CCC(CNc2ncccc2F)CC1.
What is the InChIKey of 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol?
The InChIKey is WIVFBORGROMTDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20FN3O/c14-12-2-1-5-15-13(12)16-10-11-3-6-17(7-4-11)8-9-18/h1-2,5,11,18H,3-4,6-10H2,(H,15,16).
What are the key properties of 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol?
2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol has a molecular weight of 253.32 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[(3-fluoro-2-pyridinyl)amino]methyl]piperidin-1-yl]ethanol is sourced from PubChem (CID 131891058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).