[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol

C10H20N2O2 — CID 103071362

IUPAC[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol
SMILESC=C(CNC)CN1CCOCC1CO
InChIInChI=1S/C10H20N2O2/c1-9(5-11-2)6-12-3-4-14-8-10(12)7-13/h10-11,13H,1,3-8H2,2H3
InChIKeyGAQZUODWAXGIBM-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.54
Rot. Bonds5

About [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol

[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol (PubChem CID 103071362) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol.

Molecular Properties

Compound Name[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol
PubChem CID103071362
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol
SMILESC=C(CNC)CN1CCOCC1CO
InChIInChI=1S/C10H20N2O2/c1-9(5-11-2)6-12-3-4-14-8-10(12)7-13/h10-11,13H,1,3-8H2,2H3
InChIKeyGAQZUODWAXGIBM-UHFFFAOYSA-N
XLogP-0.54
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
The IUPAC name of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol (CID 103071362) is [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol.
What is the SMILES notation for [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
The canonical SMILES for [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol is C=C(CNC)CN1CCOCC1CO.
What is the InChIKey of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
The InChIKey is GAQZUODWAXGIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9(5-11-2)6-12-3-4-14-8-10(12)7-13/h10-11,13H,1,3-8H2,2H3.
What are the key properties of [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol?
[4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol has a molecular weight of 200.28 g/mol, XLogP of -0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(methylaminomethyl)prop-2-enyl]morpholin-3-yl]methanol is sourced from PubChem (CID 103071362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).