2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine

C12H18N2O — CID 66445949

IUPAC2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine
SMILESCc1ccc(CC(N)C2CCOC2)nc1
InChIInChI=1S/C12H18N2O/c1-9-2-3-11(14-7-9)6-12(13)10-4-5-15-8-10/h2-3,7,10,12H,4-6,8,13H2,1H3
InChIKeyIXJYOECXOSAWGR-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.30
Rot. Bonds3

About 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine

2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine (PubChem CID 66445949) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine
PubChem CID66445949
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine
SMILESCc1ccc(CC(N)C2CCOC2)nc1
InChIInChI=1S/C12H18N2O/c1-9-2-3-11(14-7-9)6-12(13)10-4-5-15-8-10/h2-3,7,10,12H,4-6,8,13H2,1H3
InChIKeyIXJYOECXOSAWGR-UHFFFAOYSA-N
XLogP1.30
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-2-(5-methyl-2-pyridinyl)ethanamine
CID 66446145
1-(5-methyloxolan-2-yl)-2-(5-methyl-2-pyridinyl)ethanamine
CID 81329760
2-(5-methylpyrimidin-2-yl)sulfanyl-1-(oxolan-3-yl)ethanamine
CID 104755803
1-(oxolan-3-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 65330460
1-(3,3-difluorocyclohexyl)-2-(5-methyl-2-pyridinyl)ethanamine
CID 114226376
2-(1-methyltriazol-4-yl)-1-(oxolan-3-yl)ethanamine
CID 107049452
1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine
CID 66446718
[2-(5-ethyl-2-pyridinyl)-1-(oxolan-3-yl)ethyl]hydrazine
CID 105229310
2-(4-bromophenyl)-1-(oxolan-3-yl)ethanamine
CID 61276449
2-(2-fluoro-5-methylphenoxy)-1-(oxolan-3-yl)ethanamine
CID 104749553
(4-methylphenyl)-(oxolan-3-yl)methanamine
CID 61271786
1,1-dicyclopropyl-3-(5-methyl-2-pyridinyl)propan-2-ol
CID 112745195

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine?
The IUPAC name of 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine (CID 66445949) is 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine is Cc1ccc(CC(N)C2CCOC2)nc1.
What is the InChIKey of 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine?
The InChIKey is IXJYOECXOSAWGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-2-3-11(14-7-9)6-12(13)10-4-5-15-8-10/h2-3,7,10,12H,4-6,8,13H2,1H3.
What are the key properties of 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine?
2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine has a molecular weight of 206.29 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-pyridinyl)-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 66445949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).