2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol

C14H24N2O — CID 78952615

IUPAC2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol
SMILESCCC(CC)C(C)NCc1nc(C)ccc1O
InChIInChI=1S/C14H24N2O/c1-5-12(6-2)11(4)15-9-13-14(17)8-7-10(3)16-13/h7-8,11-12,15,17H,5-6,9H2,1-4H3
InChIKeyWHHIICWHQVBYKG-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.01
Rot. Bonds6

About 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol

2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol (PubChem CID 78952615) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol
PubChem CID78952615
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol
SMILESCCC(CC)C(C)NCc1nc(C)ccc1O
InChIInChI=1S/C14H24N2O/c1-5-12(6-2)11(4)15-9-13-14(17)8-7-10(3)16-13/h7-8,11-12,15,17H,5-6,9H2,1-4H3
InChIKeyWHHIICWHQVBYKG-UHFFFAOYSA-N
XLogP3.01
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-2-[(3-methylpentan-2-ylamino)methyl]pyridin-3-ol
CID 78928839
6-methyl-2-[(3-methylbutan-2-ylamino)methyl]pyridin-3-ol
CID 78928516
2-[[[(2R)-1-hydroxybutan-2-yl]amino]methyl]-6-methylpyridin-3-ol
CID 103924307
3-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]butanenitrile
CID 104586935
2-[(1-hydroxypentan-3-ylamino)methyl]-6-methylpyridin-3-ol
CID 111449214
6-methyl-2-[[1-(4-methylphenyl)ethylamino]methyl]pyridin-3-ol
CID 78928742
6-methyl-2-[[[(2R,3S)-3-(4-methylpyrazol-1-yl)butan-2-yl]amino]methyl]pyridin-3-ol
CID 95298588
6-methyl-2-[[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]pyridin-3-ol
CID 95275043
2-[(1-cyclohexylethylamino)methyl]-6-methylpyridin-3-ol
CID 79032200
2-[(4-butan-2-ylanilino)methyl]-6-methylpyridin-3-ol
CID 79162732
4-[(3-ethylpentan-2-ylamino)methyl]benzene-1,2-diol
CID 63843469
2-[(ethoxyamino)methyl]-6-methylpyridin-3-ol
CID 82710489

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol (CID 78952615) is 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol is CCC(CC)C(C)NCc1nc(C)ccc1O.
What is the InChIKey of 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol?
The InChIKey is WHHIICWHQVBYKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-12(6-2)11(4)15-9-13-14(17)8-7-10(3)16-13/h7-8,11-12,15,17H,5-6,9H2,1-4H3.
What are the key properties of 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol?
2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol has a molecular weight of 236.36 g/mol, XLogP of 3.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethylpentan-2-ylamino)methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 78952615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).