2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine

C11H17NO2 — CID 43367066

IUPAC2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine
SMILESCc1cc(C2CNC(C)CO2)c(C)o1
InChIInChI=1S/C11H17NO2/c1-7-6-13-11(5-12-7)10-4-8(2)14-9(10)3/h4,7,11-12H,5-6H2,1-3H3
InChIKeyIZBLLCOUQZWBDH-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.95
Rot. Bonds1

About 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine

2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine (PubChem CID 43367066) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine.

Molecular Properties

Compound Name2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine
PubChem CID43367066
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine
SMILESCc1cc(C2CNC(C)CO2)c(C)o1
InChIInChI=1S/C11H17NO2/c1-7-6-13-11(5-12-7)10-4-8(2)14-9(10)3/h4,7,11-12H,5-6H2,1-3H3
InChIKeyIZBLLCOUQZWBDH-UHFFFAOYSA-N
XLogP1.95
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,5-dimethylfuran-3-yl)-2-hydroxypropyl]-2-ethoxyacetamide
CID 71985033
N-[2-(2,5-dimethylfuran-3-yl)-2-hydroxypropyl]-3-(2-methylpropoxy)propanamide
CID 72116809
N-[(3R,4S)-3-methoxyoxan-4-yl]-2,5-dimethylfuran-3-carboxamide
CID 164638355
N-[(2R)-2-(2,5-dimethylfuran-3-yl)-2-hydroxyethyl]-3,3-dimethylbutanamide
CID 164639214
N-[(2R)-2-(2,5-dimethylfuran-3-yl)-2-hydroxyethyl]pent-4-enamide
CID 164639633
N-[[3-(2,2,2-trifluoroethoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 55073204
N-[[5-methyl-4-(2,2,2-trifluoroethoxymethyl)furan-2-yl]methyl]ethanamine
CID 55073302
2-methyl-N-[[5-methyl-4-(2,2,2-trifluoroethoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 55073348
2-methyl-N-[[3-(2,2,2-trifluoroethoxymethyl)furan-2-yl]methyl]propan-2-amine
CID 55073350
N-[[3-[(2-fluorophenoxy)methyl]furan-2-yl]methyl]propan-2-amine
CID 55076880
N-[[4-[(3-fluorophenoxy)methyl]-5-methylfuran-2-yl]methyl]ethanamine
CID 55076906
N-[[5-methyl-4-(2,2,3,3-tetrafluoropropoxymethyl)furan-2-yl]methyl]ethanamine
CID 55077656

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine?
The IUPAC name of 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine (CID 43367066) is 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine.
What is the SMILES notation for 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine?
The canonical SMILES for 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine is Cc1cc(C2CNC(C)CO2)c(C)o1.
What is the InChIKey of 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine?
The InChIKey is IZBLLCOUQZWBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-7-6-13-11(5-12-7)10-4-8(2)14-9(10)3/h4,7,11-12H,5-6H2,1-3H3.
What are the key properties of 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine?
2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine has a molecular weight of 195.26 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylfuran-3-yl)-5-methylmorpholine is sourced from PubChem (CID 43367066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).