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

C13H21NO2 — CID 105029658

IUPACN-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
SMILESCCNC(Cc1ccco1)C1COC(C)C1
InChIInChI=1S/C13H21NO2/c1-3-14-13(8-12-5-4-6-15-12)11-7-10(2)16-9-11/h4-6,10-11,13-14H,3,7-9H2,1-2H3
InChIKeySPHKWAWDNSRGHN-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.23
Rot. Bonds5

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

N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine (PubChem CID 105029658) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
PubChem CID105029658
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
SMILESCCNC(Cc1ccco1)C1COC(C)C1
InChIInChI=1S/C13H21NO2/c1-3-14-13(8-12-5-4-6-15-12)11-7-10(2)16-9-11/h4-6,10-11,13-14H,3,7-9H2,1-2H3
InChIKeySPHKWAWDNSRGHN-UHFFFAOYSA-N
XLogP2.23
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethyl]hydrazine
CID 105331645
2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanol
CID 115830123
2-(2,6-dimethylphenyl)-N-ethyl-1-(5-methyloxolan-3-yl)ethanamine
CID 105024778
N-ethyl-2-(4-iodophenyl)-1-(5-methyloxolan-3-yl)ethanamine
CID 115864436
N-ethyl-2-(5-ethylthiophen-2-yl)-1-(5-methyloxolan-3-yl)ethanamine
CID 115842776
N-ethyl-1-(3-ethylcyclohexyl)-2-(furan-2-yl)ethanamine
CID 83176158
N-ethyl-1-(5-methyloxolan-3-yl)-2-(3-methylphenyl)ethanamine
CID 114825892
1-(2-adamantyl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 105029389
N-ethyl-2-(furan-2-yl)-1-(2-methylcyclopentyl)ethanamine
CID 107190614
N-ethyl-2-(furan-2-yl)-1-(3-methyl-1,4-dithian-2-yl)ethanamine
CID 83183374
2-(2-chloro-4-methylphenyl)-N-ethyl-1-(5-methyloxolan-3-yl)ethanamine
CID 106866403
N-ethyl-1-(5-methyloxolan-3-yl)-2-(4-nitrophenyl)ethanamine
CID 114825860

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine?
The IUPAC name of N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine (CID 105029658) is N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine is CCNC(Cc1ccco1)C1COC(C)C1.
What is the InChIKey of N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine?
The InChIKey is SPHKWAWDNSRGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-3-14-13(8-12-5-4-6-15-12)11-7-10(2)16-9-11/h4-6,10-11,13-14H,3,7-9H2,1-2H3.
What are the key properties of N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine?
N-ethyl-2-(furan-2-yl)-1-(5-methyloxolan-3-yl)ethanamine has a molecular weight of 223.32 g/mol, XLogP of 2.23, 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-2-yl)-1-(5-methyloxolan-3-yl)ethanamine is sourced from PubChem (CID 105029658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).