N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine

C14H24N2O2 — CID 55074754

IUPACN-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine
SMILESCCNCc1coc(CN2CC(C)OCC2C)c1
InChIInChI=1S/C14H24N2O2/c1-4-15-6-13-5-14(18-10-13)8-16-7-12(3)17-9-11(16)2/h5,10-12,15H,4,6-9H2,1-3H3
InChIKeyWEDBKEYQXMPDPS-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.00
Rot. Bonds5

About N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine

N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine (PubChem CID 55074754) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine
PubChem CID55074754
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine
SMILESCCNCc1coc(CN2CC(C)OCC2C)c1
InChIInChI=1S/C14H24N2O2/c1-4-15-6-13-5-14(18-10-13)8-16-7-12(3)17-9-11(16)2/h5,10-12,15H,4,6-9H2,1-3H3
InChIKeyWEDBKEYQXMPDPS-UHFFFAOYSA-N
XLogP2.00
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine?
The IUPAC name of N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine (CID 55074754) is N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine is CCNCc1coc(CN2CC(C)OCC2C)c1.
What is the InChIKey of N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine?
The InChIKey is WEDBKEYQXMPDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-4-15-6-13-5-14(18-10-13)8-16-7-12(3)17-9-11(16)2/h5,10-12,15H,4,6-9H2,1-3H3.
What are the key properties of N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine?
N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine has a molecular weight of 252.36 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(2,5-dimethylmorpholin-4-yl)methyl]furan-3-yl]methyl]ethanamine is sourced from PubChem (CID 55074754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).