2-(oxolan-3-yl)-1-pyridin-3-ylethanamine

C11H16N2O — CID 22992279

IUPAC2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
SMILESNC(CC1CCOC1)c1cccnc1
InChIInChI=1S/C11H16N2O/c12-11(6-9-3-5-14-8-9)10-2-1-4-13-7-10/h1-2,4,7,9,11H,3,5-6,8,12H2
InChIKeyMQOKQNRIDBJWKR-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.51
Rot. Bonds3

About 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine

2-(oxolan-3-yl)-1-pyridin-3-ylethanamine (PubChem CID 22992279) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
PubChem CID22992279
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
SMILESNC(CC1CCOC1)c1cccnc1
InChIInChI=1S/C11H16N2O/c12-11(6-9-3-5-14-8-9)10-2-1-4-13-7-10/h1-2,4,7,9,11H,3,5-6,8,12H2
InChIKeyMQOKQNRIDBJWKR-UHFFFAOYSA-N
XLogP1.51
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
The IUPAC name of 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine (CID 22992279) is 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine is NC(CC1CCOC1)c1cccnc1.
What is the InChIKey of 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
The InChIKey is MQOKQNRIDBJWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c12-11(6-9-3-5-14-8-9)10-2-1-4-13-7-10/h1-2,4,7,9,11H,3,5-6,8,12H2.
What are the key properties of 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine?
2-(oxolan-3-yl)-1-pyridin-3-ylethanamine has a molecular weight of 192.26 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-yl)-1-pyridin-3-ylethanamine is sourced from PubChem (CID 22992279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).