N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine

C13H17NO2 — CID 105029983

IUPACN-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine
SMILESCCNC(Cc1ccoc1)c1ccc(C)o1
InChIInChI=1S/C13H17NO2/c1-3-14-12(8-11-6-7-15-9-11)13-5-4-10(2)16-13/h4-7,9,12,14H,3,8H2,1-2H3
InChIKeyYOJBBVBQWNPHAZ-UHFFFAOYSA-N
MW219.28 g/mol
LogP3.07
Rot. Bonds5

About N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine

N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine (PubChem CID 105029983) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine
PubChem CID105029983
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC NameN-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine
SMILESCCNC(Cc1ccoc1)c1ccc(C)o1
InChIInChI=1S/C13H17NO2/c1-3-14-12(8-11-6-7-15-9-11)13-5-4-10(2)16-13/h4-7,9,12,14H,3,8H2,1-2H3
InChIKeyYOJBBVBQWNPHAZ-UHFFFAOYSA-N
XLogP3.07
TPSA38.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-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-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine?
The IUPAC name of N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine (CID 105029983) is N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine is CCNC(Cc1ccoc1)c1ccc(C)o1.
What is the InChIKey of N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine?
The InChIKey is YOJBBVBQWNPHAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-3-14-12(8-11-6-7-15-9-11)13-5-4-10(2)16-13/h4-7,9,12,14H,3,8H2,1-2H3.
What are the key properties of N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine?
N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine has a molecular weight of 219.28 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanamine is sourced from PubChem (CID 105029983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).