[5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine

C11H18N2O2 — CID 62422880

IUPAC[5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine
SMILESCC1COCCN1Cc1cc(CN)co1
InChIInChI=1S/C11H18N2O2/c1-9-7-14-3-2-13(9)6-11-4-10(5-12)8-15-11/h4,8-9H,2-3,5-7,12H2,1H3
InChIKeyOPROWQOIGMPJFO-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.96
Rot. Bonds3

About [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine

[5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine (PubChem CID 62422880) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine.

Molecular Properties

Compound Name[5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine
PubChem CID62422880
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name[5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine
SMILESCC1COCCN1Cc1cc(CN)co1
InChIInChI=1S/C11H18N2O2/c1-9-7-14-3-2-13(9)6-11-4-10(5-12)8-15-11/h4,8-9H,2-3,5-7,12H2,1H3
InChIKeyOPROWQOIGMPJFO-UHFFFAOYSA-N
XLogP0.96
TPSA51.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
The IUPAC name of [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine (CID 62422880) is [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine.
What is the SMILES notation for [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
The canonical SMILES for [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine is CC1COCCN1Cc1cc(CN)co1.
What is the InChIKey of [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
The InChIKey is OPROWQOIGMPJFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-9-7-14-3-2-13(9)6-11-4-10(5-12)8-15-11/h4,8-9H,2-3,5-7,12H2,1H3.
What are the key properties of [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine?
[5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine has a molecular weight of 210.28 g/mol, XLogP of 0.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-methylmorpholin-4-yl)methyl]furan-3-yl]methanamine is sourced from PubChem (CID 62422880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).