(E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol

C11H21NO2 — CID 134906468

IUPAC(E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol
SMILESCC(C)(O)C/C=C/CN1CCOCC1
InChIInChI=1S/C11H21NO2/c1-11(2,13)5-3-4-6-12-7-9-14-10-8-12/h3-4,13H,5-10H2,1-2H3/b4-3+
InChIKeyCXKFZLGNDZOCNI-ONEGZZNKSA-N
MW199.29 g/mol
LogP1.04
Rot. Bonds4

About (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol

(E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol (PubChem CID 134906468) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol.

Molecular Properties

Compound Name(E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol
PubChem CID134906468
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name(E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol
SMILESCC(C)(O)C/C=C/CN1CCOCC1
InChIInChI=1S/C11H21NO2/c1-11(2,13)5-3-4-6-12-7-9-14-10-8-12/h3-4,13H,5-10H2,1-2H3/b4-3+
InChIKeyCXKFZLGNDZOCNI-ONEGZZNKSA-N
XLogP1.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol?
The IUPAC name of (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol (CID 134906468) is (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol.
What is the SMILES notation for (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol?
The canonical SMILES for (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol is CC(C)(O)C/C=C/CN1CCOCC1.
What is the InChIKey of (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol?
The InChIKey is CXKFZLGNDZOCNI-ONEGZZNKSA-N. The full InChI is InChI=1S/C11H21NO2/c1-11(2,13)5-3-4-6-12-7-9-14-10-8-12/h3-4,13H,5-10H2,1-2H3/b4-3+.
What are the key properties of (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol?
(E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol has a molecular weight of 199.29 g/mol, XLogP of 1.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methyl-6-morpholin-4-ylhex-4-en-2-ol is sourced from PubChem (CID 134906468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).