1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine

C12H15NO2 — CID 105029404

IUPAC1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine
SMILESCc1cc(C(N)Cc2ccco2)c(C)o1
InChIInChI=1S/C12H15NO2/c1-8-6-11(9(2)15-8)12(13)7-10-4-3-5-14-10/h3-6,12H,7,13H2,1-2H3
InChIKeyZTCAPMVLVDPZNJ-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.73
Rot. Bonds3

About 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine

1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine (PubChem CID 105029404) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine
PubChem CID105029404
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine
SMILESCc1cc(C(N)Cc2ccco2)c(C)o1
InChIInChI=1S/C12H15NO2/c1-8-6-11(9(2)15-8)12(13)7-10-4-3-5-14-10/h3-6,12H,7,13H2,1-2H3
InChIKeyZTCAPMVLVDPZNJ-UHFFFAOYSA-N
XLogP2.73
TPSA52.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,5-dimethylfuran-3-yl)-2-(furan-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

Related Compounds

1-(2,5-dimethylfuran-3-yl)-2-(4-methylphenyl)ethanamine
CID 54979824
1-(2-fluoro-3-methylphenyl)-2-(furan-2-yl)ethanamine
CID 105029224
1-(2-bromo-3-methylphenyl)-2-(furan-2-yl)ethanamine
CID 107985336
2-(furan-2-yl)-1-(2-methoxy-4-methylphenyl)ethanamine
CID 106791252
2-(furan-2-yl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 105029210
N-[1-(2,5-dimethylfuran-3-yl)ethyl]-4-(furan-2-yl)butan-2-amine
CID 43121413
2-(furan-2-yl)-1-(2-iodophenyl)ethanamine
CID 105029496
2-(furan-2-yl)-1-(3-methylfuran-2-yl)ethanamine
CID 104804301
1-(2,5-dichlorophenyl)-2-(furan-2-yl)ethanamine
CID 105029387
(2R)-2-amino-2-(2,5-dimethylfuran-3-yl)ethanol
CID 96734857
1-(4,5-dimethylthiophen-2-yl)-2-(furan-2-yl)ethanamine
CID 105029526
1-(4-chloro-2-fluorophenyl)-2-(furan-2-yl)ethanamine
CID 83175328

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine?
The IUPAC name of 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine (CID 105029404) is 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine is Cc1cc(C(N)Cc2ccco2)c(C)o1.
What is the InChIKey of 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine?
The InChIKey is ZTCAPMVLVDPZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-8-6-11(9(2)15-8)12(13)7-10-4-3-5-14-10/h3-6,12H,7,13H2,1-2H3.
What are the key properties of 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine?
1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine has a molecular weight of 205.26 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylfuran-3-yl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 105029404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).