N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine

C11H19NO2 — CID 105008302

IUPACN-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine
SMILESCCCOCC(NC)c1coc(C)c1
InChIInChI=1S/C11H19NO2/c1-4-5-13-8-11(12-3)10-6-9(2)14-7-10/h6-7,11-12H,4-5,8H2,1-3H3
InChIKeyMUVRWFHOJJVZOE-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.28
Rot. Bonds6

About N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine

N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine (PubChem CID 105008302) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine
PubChem CID105008302
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC NameN-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine
SMILESCCCOCC(NC)c1coc(C)c1
InChIInChI=1S/C11H19NO2/c1-4-5-13-8-11(12-3)10-6-9(2)14-7-10/h6-7,11-12H,4-5,8H2,1-3H3
InChIKeyMUVRWFHOJJVZOE-UHFFFAOYSA-N
XLogP2.28
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxy-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 105007859
N-methyl-1-(5-methylfuran-3-yl)tridecan-1-amine
CID 115846501
[2-ethoxy-1-(5-methylfuran-3-yl)ethyl]hydrazine
CID 105321262
N-methyl-1-(5-methylfuran-3-yl)nonan-1-amine
CID 115835205
2-ethoxy-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 105008082
N-methyl-1-naphthalen-2-yl-2-(2-propoxyethoxy)ethanamine
CID 63685085
N-methyl-1-(6-methyl-3-pyridinyl)-2-propoxyethanamine
CID 63155924
1-(3-iodophenyl)-N-methyl-2-propoxyethanamine
CID 105008577
N-methyl-1-(4-propan-2-yloxyphenyl)-2-(2-propoxyethoxy)ethanamine
CID 63685624
N-methyl-1-(5-methylfuran-3-yl)-1-(4-propoxyphenyl)methanamine
CID 115853275
1-(3-fluoro-4-methoxyphenyl)-N-methyl-2-propoxyethanamine
CID 62797505
2-(5-ethylthiophen-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 115842340

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine?
The IUPAC name of N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine (CID 105008302) is N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine.
What is the SMILES notation for N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine?
The canonical SMILES for N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine is CCCOCC(NC)c1coc(C)c1.
What is the InChIKey of N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine?
The InChIKey is MUVRWFHOJJVZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-4-5-13-8-11(12-3)10-6-9(2)14-7-10/h6-7,11-12H,4-5,8H2,1-3H3.
What are the key properties of N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine?
N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine has a molecular weight of 197.28 g/mol, XLogP of 2.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methylfuran-3-yl)-2-propoxyethanamine is sourced from PubChem (CID 105008302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).