N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine

C11H20N2O2 — CID 62458407

IUPACN,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine
SMILESCNCc1ccoc1COCCN(C)C
InChIInChI=1S/C11H20N2O2/c1-12-8-10-4-6-15-11(10)9-14-7-5-13(2)3/h4,6,12H,5,7-9H2,1-3H3
InChIKeyWJWQBIUBWZPUTD-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.08
Rot. Bonds7

About N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine

N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine (PubChem CID 62458407) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine
PubChem CID62458407
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine
SMILESCNCc1ccoc1COCCN(C)C
InChIInChI=1S/C11H20N2O2/c1-12-8-10-4-6-15-11(10)9-14-7-5-13(2)3/h4,6,12H,5,7-9H2,1-3H3
InChIKeyWJWQBIUBWZPUTD-UHFFFAOYSA-N
XLogP1.08
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(3,3-dimethylbutoxymethyl)furan-3-yl]-N-methylmethanamine
CID 66225474
N-methyl-1-[2-(4-methylpentoxymethyl)furan-3-yl]methanamine
CID 62455304
N-methyl-1-[2-(3-methylbut-3-enoxymethyl)furan-3-yl]methanamine
CID 114470811
N-[[3-[2-(dimethylamino)ethoxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62460189
1-[2-(but-2-enoxymethyl)furan-3-yl]-N-methylmethanamine
CID 76943462
1-[2-(cyclopentylmethoxymethyl)furan-3-yl]-N-methylmethanamine
CID 66321220
N-methyl-1-[2-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]furan-3-yl]methanamine
CID 62455359
N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine
CID 55133858
N-[[2-(heptoxymethyl)furan-3-yl]methyl]ethanamine
CID 62455259
2-methyl-N-[[2-[2-(2-methylpropoxy)ethoxymethyl]furan-3-yl]methyl]propan-1-amine
CID 106449856
1-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxymethyl)furan-3-yl]-N-methylmethanamine
CID 102723192
1-[2-[(3,5-dimethylphenoxy)methyl]furan-3-yl]-N-methylmethanamine
CID 62452698

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine?
The IUPAC name of N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine (CID 62458407) is N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine.
What is the SMILES notation for N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine?
The canonical SMILES for N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine is CNCc1ccoc1COCCN(C)C.
What is the InChIKey of N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine?
The InChIKey is WJWQBIUBWZPUTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-12-8-10-4-6-15-11(10)9-14-7-5-13(2)3/h4,6,12H,5,7-9H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine?
N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine has a molecular weight of 212.29 g/mol, XLogP of 1.08, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine is sourced from PubChem (CID 62458407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).