N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine

C13H20N2O — CID 61039958

IUPACN-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine
SMILESCC(NCCC1CCCO1)c1ccccn1
InChIInChI=1S/C13H20N2O/c1-11(13-6-2-3-8-15-13)14-9-7-12-5-4-10-16-12/h2-3,6,8,11-12,14H,4-5,7,9-10H2,1H3
InChIKeyIFWWBSFUBBZHMN-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.30
Rot. Bonds5

About N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine

N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine (PubChem CID 61039958) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine
PubChem CID61039958
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine
SMILESCC(NCCC1CCCO1)c1ccccn1
InChIInChI=1S/C13H20N2O/c1-11(13-6-2-3-8-15-13)14-9-7-12-5-4-10-16-12/h2-3,6,8,11-12,14H,4-5,7,9-10H2,1H3
InChIKeyIFWWBSFUBBZHMN-UHFFFAOYSA-N
XLogP2.30
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(oxolan-2-yl)-N-[phenyl(pyridin-2-yl)methyl]ethanamine
CID 61039844
(1S)-N-[2-(oxolan-2-yl)ethyl]-1-phenylethanamine
CID 65163698
1-(oxolan-2-yl)-N-propyl-3-pyridin-2-ylbutan-2-amine
CID 66446842
3-(oxolan-2-yl)-1-pyridin-2-ylpropan-1-ol
CID 65161757
(1S)-N-[2-(oxolan-2-yl)ethyl]-1-thiophen-2-ylethanamine
CID 81409134
2-[3-bromo-4-(oxolan-2-yl)butan-2-yl]pyridine
CID 66453344
1-(2-bromophenyl)-N-[2-(oxan-2-yl)ethyl]ethanamine
CID 103983659
1-(2,5-dimethylphenyl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 54917016
1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine
CID 113364696
(1R)-1-(3-fluorophenyl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 81364895
(1S)-1-(3-fluorophenyl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 81365361
N-(cyclopentylmethyl)-1-pyridin-2-ylethanamine
CID 21279046

Frequently Asked Questions

What is the IUPAC name of N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine?
The IUPAC name of N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine (CID 61039958) is N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine.
What is the SMILES notation for N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine?
The canonical SMILES for N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine is CC(NCCC1CCCO1)c1ccccn1.
What is the InChIKey of N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine?
The InChIKey is IFWWBSFUBBZHMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11(13-6-2-3-8-15-13)14-9-7-12-5-4-10-16-12/h2-3,6,8,11-12,14H,4-5,7,9-10H2,1H3.
What are the key properties of N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine?
N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine has a molecular weight of 220.32 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine is sourced from PubChem (CID 61039958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).