2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine

C13H20N2O — CID 83822430

IUPAC2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine
SMILESCc1ccc(C2(CCN)CCOCC2)cn1
InChIInChI=1S/C13H20N2O/c1-11-2-3-12(10-15-11)13(4-7-14)5-8-16-9-6-13/h2-3,10H,4-9,14H2,1H3
InChIKeyCNPLTHJJLHDFHU-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.79
Rot. Bonds3

About 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine

2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine (PubChem CID 83822430) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine
PubChem CID83822430
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine
SMILESCc1ccc(C2(CCN)CCOCC2)cn1
InChIInChI=1S/C13H20N2O/c1-11-2-3-12(10-15-11)13(4-7-14)5-8-16-9-6-13/h2-3,10H,4-9,14H2,1H3
InChIKeyCNPLTHJJLHDFHU-UHFFFAOYSA-N
XLogP1.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;4-(6-methyl-3-pyridinyl)oxan-4-ol
CID 156651418
2-[3-(2-methylpyrimidin-5-yl)oxan-3-yl]ethanamine
CID 83822644
[1-methyl-3-(6-methyl-3-pyridinyl)pyrrolidin-3-yl]methanamine
CID 83819952
[4-(aminomethyl)oxan-4-yl]-(6-methyl-3-pyridinyl)methanol
CID 104824016
2-(4-thiophen-2-yloxan-4-yl)ethanamine
CID 83820999
N-[4-(aminomethyl)oxan-4-yl]-6-methylpyridine-3-carboxamide
CID 114170027
1-(6-methyl-3-pyridinyl)cycloheptan-1-amine
CID 63155403
2-[1-(4-methylphenyl)cyclohexyl]ethanamine
CID 82079127
(4-aminooxan-4-yl)-(6-methyl-3-pyridinyl)methanone
CID 116604510
2-(1-pyridin-3-ylcyclohexyl)ethanamine
CID 83819763
2-[4-(2-chlorophenyl)oxan-4-yl]ethanamine
CID 82084431
(4-methoxyoxan-4-yl)-(6-methyl-3-pyridinyl)methanone
CID 116748710

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine?
The IUPAC name of 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine (CID 83822430) is 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine.
What is the SMILES notation for 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine?
The canonical SMILES for 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine is Cc1ccc(C2(CCN)CCOCC2)cn1.
What is the InChIKey of 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine?
The InChIKey is CNPLTHJJLHDFHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11-2-3-12(10-15-11)13(4-7-14)5-8-16-9-6-13/h2-3,10H,4-9,14H2,1H3.
What are the key properties of 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine?
2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine has a molecular weight of 220.32 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-methyl-3-pyridinyl)oxan-4-yl]ethanamine is sourced from PubChem (CID 83822430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).