2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol

C15H24N2O — CID 79032200

IUPAC2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNC(C)C2CCCCC2)n1
InChIInChI=1S/C15H24N2O/c1-11-8-9-15(18)14(17-11)10-16-12(2)13-6-4-3-5-7-13/h8-9,12-13,16,18H,3-7,10H2,1-2H3
InChIKeyFVIOTFHVSTXOCR-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.15
Rot. Bonds4

About 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol

2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol (PubChem CID 79032200) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol
PubChem CID79032200
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CNC(C)C2CCCCC2)n1
InChIInChI=1S/C15H24N2O/c1-11-8-9-15(18)14(17-11)10-16-12(2)13-6-4-3-5-7-13/h8-9,12-13,16,18H,3-7,10H2,1-2H3
InChIKeyFVIOTFHVSTXOCR-UHFFFAOYSA-N
XLogP3.15
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-[[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]amino]methyl]pyridin-3-ol
CID 124528159
2-[(cyclobutylamino)methyl]-6-methylpyridin-3-ol
CID 78950424
4-[[[(1R)-1-cycloheptylethyl]amino]methyl]benzene-1,2,3-triol
CID 107730932
1-[[[(1R)-1-cyclohexylethyl]amino]methyl]naphthalen-2-ol
CID 81388297
3-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]butanenitrile
CID 104586935
(1R)-1-cycloheptyl-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 113449658
(1R)-1-cyclohexyl-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 94912990
2-[[[(1S)-1-cyclopentylethyl]amino]methyl]phenol
CID 81386738
6-methyl-2-[(3-methylpentan-2-ylamino)methyl]pyridin-3-ol
CID 78928839
1-[[[(1R)-1-cyclopentylethyl]amino]methyl]naphthalen-2-ol
CID 81394953
2-[[(4-hydroxycyclohexyl)amino]methyl]-6-methylpyridin-3-ol
CID 78928626
6-methyl-2-[[1-(4-methylphenyl)ethylamino]methyl]pyridin-3-ol
CID 78928742

Frequently Asked Questions

What is the IUPAC name of 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol (CID 79032200) is 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol is Cc1ccc(O)c(CNC(C)C2CCCCC2)n1.
What is the InChIKey of 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol?
The InChIKey is FVIOTFHVSTXOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11-8-9-15(18)14(17-11)10-16-12(2)13-6-4-3-5-7-13/h8-9,12-13,16,18H,3-7,10H2,1-2H3.
What are the key properties of 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol?
2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol has a molecular weight of 248.37 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 79032200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).