2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol

C12H17FN2O — CID 102635994

IUPAC2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol
SMILESCN(c1ncccc1F)C1CCCCC1O
InChIInChI=1S/C12H17FN2O/c1-15(10-6-2-3-7-11(10)16)12-9(13)5-4-8-14-12/h4-5,8,10-11,16H,2-3,6-7H2,1H3
InChIKeyWGHIHXUZQHIJAM-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.96
Rot. Bonds2

About 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol

2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol (PubChem CID 102635994) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol
PubChem CID102635994
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol
SMILESCN(c1ncccc1F)C1CCCCC1O
InChIInChI=1S/C12H17FN2O/c1-15(10-6-2-3-7-11(10)16)12-9(13)5-4-8-14-12/h4-5,8,10-11,16H,2-3,6-7H2,1H3
InChIKeyWGHIHXUZQHIJAM-UHFFFAOYSA-N
XLogP1.96
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromocyclohexyl)-3-fluoro-N-methylpyridin-2-amine
CID 102637629
2-[(2-hydroxycyclohexyl)-methylamino]pyridine-3-carbothioamide
CID 102632263
2-[methyl(pyridazin-3-yl)amino]cyclohexan-1-ol
CID 102636109
2-[(5-fluoro-2-hydrazinylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102640251
2-[(5-aminoquinolin-6-yl)-methylamino]cyclohexan-1-ol
CID 102631412
2-[[4-(hydroxymethyl)isoquinolin-1-yl]-methylamino]cyclohexan-1-ol
CID 106768455
trans-(1R,2R)-2-[(5-fluoropyrimidin-4-yl)-methylamino]cyclobutan-1-ol
CID 139022856
2-[methyl-(2-methyl-4-pyridinyl)amino]cyclohexan-1-ol
CID 102635956
1-(3-fluoro-2-pyridinyl)-1-methylhydrazine
CID 53402758
2-[(4-chlorophthalazin-1-yl)-methylamino]cyclohexan-1-ol
CID 102633750
2-[(2-amino-4-pyridinyl)-methylamino]cyclohexan-1-ol
CID 102640081
2-[(2-chloro-4-pyridinyl)-methylamino]cyclohexan-1-ol
CID 102824414

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol?
The IUPAC name of 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol (CID 102635994) is 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol.
What is the SMILES notation for 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol?
The canonical SMILES for 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol is CN(c1ncccc1F)C1CCCCC1O.
What is the InChIKey of 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol?
The InChIKey is WGHIHXUZQHIJAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-15(10-6-2-3-7-11(10)16)12-9(13)5-4-8-14-12/h4-5,8,10-11,16H,2-3,6-7H2,1H3.
What are the key properties of 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol?
2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol has a molecular weight of 224.28 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluoro-2-pyridinyl)-methylamino]cyclohexan-1-ol is sourced from PubChem (CID 102635994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).