[2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone

C11H16N2O3 — CID 81212515

IUPAC[2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone
SMILESCC1COC(CN)CN1C(=O)c1ccco1
InChIInChI=1S/C11H16N2O3/c1-8-7-16-9(5-12)6-13(8)11(14)10-3-2-4-15-10/h2-4,8-9H,5-7,12H2,1H3
InChIKeyNRLHHOGARSZBTM-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.47
Rot. Bonds2

About [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone

[2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone (PubChem CID 81212515) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone
PubChem CID81212515
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name[2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone
SMILESCC1COC(CN)CN1C(=O)c1ccco1
InChIInChI=1S/C11H16N2O3/c1-8-7-16-9(5-12)6-13(8)11(14)10-3-2-4-15-10/h2-4,8-9H,5-7,12H2,1H3
InChIKeyNRLHHOGARSZBTM-UHFFFAOYSA-N
XLogP0.47
TPSA68.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(chloromethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone
CID 81212054
furan-2-yl-(2-methylaziridin-1-yl)methanone
CID 71425455
2-(aminomethyl)-5-methyl-N-phenylmorpholine-4-carboxamide
CID 81217697
[2-(aminomethyl)-5-methylmorpholin-4-yl]-(3-hydroxy-4-pyridinyl)methanone
CID 81442735
[2-(aminomethyl)-5-methylmorpholin-4-yl]-(3-hydroxy-4-methoxyphenyl)methanone
CID 81211614
(2-benzyl-5-methylmorpholin-4-yl)-(2-methylphenyl)methanone
CID 110644004
1-[2-(chloromethyl)-5-methylmorpholin-4-yl]-3-(furan-2-yl)propan-1-one
CID 81212458
[2-(aminomethyl)-5-methylmorpholin-4-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 81211451
1-[2-(aminomethyl)-5-methylmorpholin-4-yl]hexan-1-one
CID 81211868
[3-(chloromethyl)phenyl]-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]methanone
CID 81203352
[2-(bromomethyl)-5-methylmorpholin-4-yl]-(2,6-dihydroxyphenyl)methanone
CID 107691054
1-(2-benzyl-5-methylmorpholin-4-yl)propan-1-one
CID 110643992

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone?
The IUPAC name of [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone (CID 81212515) is [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone?
The canonical SMILES for [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone is CC1COC(CN)CN1C(=O)c1ccco1.
What is the InChIKey of [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone?
The InChIKey is NRLHHOGARSZBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-8-7-16-9(5-12)6-13(8)11(14)10-3-2-4-15-10/h2-4,8-9H,5-7,12H2,1H3.
What are the key properties of [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone?
[2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone has a molecular weight of 224.26 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-5-methylmorpholin-4-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 81212515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).