N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine

C14H21N3O2 — CID 51081810

IUPACN-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine
SMILESCCCc1noc(C(C)N(CC)Cc2ccco2)n1
InChIInChI=1S/C14H21N3O2/c1-4-7-13-15-14(19-16-13)11(3)17(5-2)10-12-8-6-9-18-12/h6,8-9,11H,4-5,7,10H2,1-3H3
InChIKeyQBWLBMMZEBYQOM-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.20
Rot. Bonds7

About N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine

N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine (PubChem CID 51081810) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine
PubChem CID51081810
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine
SMILESCCCc1noc(C(C)N(CC)Cc2ccco2)n1
InChIInChI=1S/C14H21N3O2/c1-4-7-13-15-14(19-16-13)11(3)17(5-2)10-12-8-6-9-18-12/h6,8-9,11H,4-5,7,10H2,1-3H3
InChIKeyQBWLBMMZEBYQOM-UHFFFAOYSA-N
XLogP3.20
TPSA55.30 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-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-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine?
The IUPAC name of N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine (CID 51081810) is N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine.
What is the SMILES notation for N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine?
The canonical SMILES for N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine is CCCc1noc(C(C)N(CC)Cc2ccco2)n1.
What is the InChIKey of N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine?
The InChIKey is QBWLBMMZEBYQOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-4-7-13-15-14(19-16-13)11(3)17(5-2)10-12-8-6-9-18-12/h6,8-9,11H,4-5,7,10H2,1-3H3.
What are the key properties of N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine?
N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine has a molecular weight of 263.34 g/mol, XLogP of 3.20, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(furan-2-ylmethyl)-1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine is sourced from PubChem (CID 51081810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).