N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine

C13H20N2O — CID 144767444

IUPACN-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine
SMILESCCN(Cc1ccccn1)CC1CCCO1
InChIInChI=1S/C13H20N2O/c1-2-15(11-13-7-5-9-16-13)10-12-6-3-4-8-14-12/h3-4,6,8,13H,2,5,7,9-11H2,1H3
InChIKeyPJCNNOFDIAJJAW-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.08
Rot. Bonds5

About N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine

N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine (PubChem CID 144767444) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine
PubChem CID144767444
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine
SMILESCCN(Cc1ccccn1)CC1CCCO1
InChIInChI=1S/C13H20N2O/c1-2-15(11-13-7-5-9-16-13)10-12-6-3-4-8-14-12/h3-4,6,8,13H,2,5,7,9-11H2,1H3
InChIKeyPJCNNOFDIAJJAW-UHFFFAOYSA-N
XLogP2.08
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methoxyphenyl)methyl]-1-[(2R)-oxolan-2-yl]-N-(pyridin-2-ylmethyl)methanamine
CID 95275137
N-methyl-3-[[oxolan-2-ylmethyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
CID 46983238
N-[[2-(4-methylphenyl)pyrimidin-5-yl]methyl]-1-[(2R)-oxolan-2-yl]-N-(pyridin-2-ylmethyl)methanamine
CID 92614286
N-[[2-(aminomethyl)-3-pyridinyl]methyl]-N-(oxolan-2-ylmethyl)ethanamine
CID 62894833
1-(oxolan-2-yl)-N-(pyridin-2-ylmethyl)-N-([1,2,4]triazolo[1,5-a]pyrimidin-2-ylmethyl)methanamine
CID 135099921
N-[(6-ethoxy-1,3-benzodioxol-5-yl)methyl]-1-(oxolan-2-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 43818156
N-ethyl-2-[[ethyl(oxolan-2-ylmethyl)amino]methyl]pyridin-4-amine
CID 79245776
3,5-dimethyl-2-[[oxolan-2-ylmethyl(pyridin-2-ylmethyl)amino]methyl]-1H-pyridin-4-one
CID 135112625
3-(3,5-dimethylpyrazol-1-yl)-N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)propan-1-amine
CID 46982503
N-[(1-ethylindol-4-yl)methyl]-1-[(2R)-oxolan-2-yl]-N-(pyridin-2-ylmethyl)methanamine
CID 99929466
N-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]-1-(oxolan-2-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 45235431
N-[[1-(4-fluorophenyl)-3,5-dimethylpyrazol-4-yl]methyl]-1-(oxolan-2-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 46979426

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine?
The IUPAC name of N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine (CID 144767444) is N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine?
The canonical SMILES for N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine is CCN(Cc1ccccn1)CC1CCCO1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine?
The InChIKey is PJCNNOFDIAJJAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-15(11-13-7-5-9-16-13)10-12-6-3-4-8-14-12/h3-4,6,8,13H,2,5,7,9-11H2,1H3.
What are the key properties of N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine?
N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine has a molecular weight of 220.32 g/mol, XLogP of 2.08, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-N-(pyridin-2-ylmethyl)ethanamine is sourced from PubChem (CID 144767444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).