N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine

C11H18N2O2 — CID 65183564

IUPACN-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine
SMILESCCNCCc1ncc(C2CCOC2)o1
InChIInChI=1S/C11H18N2O2/c1-2-12-5-3-11-13-7-10(15-11)9-4-6-14-8-9/h7,9,12H,2-6,8H2,1H3
InChIKeyVPZIQDPLQOZMSH-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.33
Rot. Bonds5

About N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine

N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine (PubChem CID 65183564) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine
PubChem CID65183564
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine
SMILESCCNCCc1ncc(C2CCOC2)o1
InChIInChI=1S/C11H18N2O2/c1-2-12-5-3-11-13-7-10(15-11)9-4-6-14-8-9/h7,9,12H,2-6,8H2,1H3
InChIKeyVPZIQDPLQOZMSH-UHFFFAOYSA-N
XLogP1.33
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine 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 N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine?
The IUPAC name of N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine (CID 65183564) is N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine.
What is the SMILES notation for N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine?
The canonical SMILES for N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine is CCNCCc1ncc(C2CCOC2)o1.
What is the InChIKey of N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine?
The InChIKey is VPZIQDPLQOZMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-2-12-5-3-11-13-7-10(15-11)9-4-6-14-8-9/h7,9,12H,2-6,8H2,1H3.
What are the key properties of N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine?
N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine has a molecular weight of 210.28 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[5-(oxolan-3-yl)-1,3-oxazol-2-yl]ethanamine is sourced from PubChem (CID 65183564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).