[4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine

C13H22N2O2 — CID 103486328

IUPAC[4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine
SMILESCCOCC(C)Oc1cc(C)nc(C)c1CN
InChIInChI=1S/C13H22N2O2/c1-5-16-8-10(3)17-13-6-9(2)15-11(4)12(13)7-14/h6,10H,5,7-8,14H2,1-4H3
InChIKeyGFRGTPWAEPUJOH-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.96
Rot. Bonds6

About [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine

[4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine (PubChem CID 103486328) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine
PubChem CID103486328
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name[4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine
SMILESCCOCC(C)Oc1cc(C)nc(C)c1CN
InChIInChI=1S/C13H22N2O2/c1-5-16-8-10(3)17-13-6-9(2)15-11(4)12(13)7-14/h6,10H,5,7-8,14H2,1-4H3
InChIKeyGFRGTPWAEPUJOH-UHFFFAOYSA-N
XLogP1.96
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-Methoxy-4,6-dimethylpyridin-3-yl)methanamine
CID 28064222
[(2-Methoxy-4,6-dimethylpyridin-3-yl)methyl](methyl)amine
CID 62291728
(2-Methoxy-6-methylpyridin-4-yl)methanamine
CID 72216158
(2-Methoxy-4,6-dimethylpyridin-3-yl)methanamine dihydrochloride
CID 69278478
[4-(2-Methoxyethoxy)pyridin-2-yl]methanamine
CID 62292533
(4-Methoxy-6-methylpyridin-2-yl)methanamine
CID 72215988
1-(4-(3-Methoxypropoxy)-3-methylpyridin-2-yl)methanamine dihydrochloride
CID 155970923
2,6-Dimethyl-4-(phenylmethoxy)-pyridine
CID 90368017
2-Methyl-6-(2-propan-2-yloxyethoxy)-4-(trifluoromethyl)pyridine
CID 23380555
4-(2-Methoxyethoxy)-2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 58439642
[4-Methyl-2-pentoxy-6-(trifluoromethyl)pyridin-3-yl]methanamine
CID 58873327
[2-Nonan-5-yloxy-6-(trifluoromethyl)pyridin-3-yl]methanamine
CID 58873485

Frequently Asked Questions

What is the IUPAC name of [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine?
The IUPAC name of [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine (CID 103486328) is [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine?
The canonical SMILES for [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine is CCOCC(C)Oc1cc(C)nc(C)c1CN.
What is the InChIKey of [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine?
The InChIKey is GFRGTPWAEPUJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-5-16-8-10(3)17-13-6-9(2)15-11(4)12(13)7-14/h6,10H,5,7-8,14H2,1-4H3.
What are the key properties of [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine?
[4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine has a molecular weight of 238.33 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-ethoxypropan-2-yloxy)-2,6-dimethyl-3-pyridinyl]methanamine is sourced from PubChem (CID 103486328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).