(2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine

C11H18N2O — CID 126584068

IUPAC(2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine
SMILESC=CN/C(C)=C/C(=C)N1CCOCC1
InChIInChI=1S/C11H18N2O/c1-4-12-10(2)9-11(3)13-5-7-14-8-6-13/h4,9,12H,1,3,5-8H2,2H3/b10-9+
InChIKeyVRGYXPBURUQCIQ-MDZDMXLPSA-N
MW194.28 g/mol
LogP1.47
Rot. Bonds4

About (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine

(2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine (PubChem CID 126584068) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine.

Molecular Properties

Compound Name(2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine
PubChem CID126584068
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine
SMILESC=CN/C(C)=C/C(=C)N1CCOCC1
InChIInChI=1S/C11H18N2O/c1-4-12-10(2)9-11(3)13-5-7-14-8-6-13/h4,9,12H,1,3,5-8H2,2H3/b10-9+
InChIKeyVRGYXPBURUQCIQ-MDZDMXLPSA-N
XLogP1.47
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2E,4Z)-1-fluoro-6-morpholin-4-ylhexa-2,4-dien-3-amine
CID 89774520
(3E)-4-fluoro-5-morpholin-4-ylhexa-1,3,5-trien-2-amine
CID 142898847
(2E,4E)-5-fluoro-6-morpholin-4-ylhepta-2,4,6-trien-3-amine
CID 143062168
N-methylmorpholinium dihydropyridinethiolate
CID 129764221
(2E,4Z)-3,5-difluoro-4-morpholin-4-ylhepta-2,4,6-trien-1-amine
CID 142263642
3-fluoro-N-methyl-4-morpholin-4-ylcyclohepta-2,4,6-trien-1-amine
CID 143162412
4-morpholin-4-yl-1H-pyridine-2-thione
CID 18930879
4-[(3E)-penta-1,3-dien-3-yl]morpholine
CID 22149528
N-(2-morpholin-4-ylethyl)prop-1-en-1-amine
CID 57636132
N-(2-methoxy-1-methyl-ethyl)-2,5-diaminopyridine
CID 67535953
4-methylmorpholine;N-prop-2-enylprop-2-en-1-amine
CID 68543856
morpholine;1-prop-2-enyl-2H-pyridine
CID 70522385

Frequently Asked Questions

What is the IUPAC name of (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine?
The IUPAC name of (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine (CID 126584068) is (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine.
What is the SMILES notation for (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine?
The canonical SMILES for (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine is C=CN/C(C)=C/C(=C)N1CCOCC1.
What is the InChIKey of (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine?
The InChIKey is VRGYXPBURUQCIQ-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H18N2O/c1-4-12-10(2)9-11(3)13-5-7-14-8-6-13/h4,9,12H,1,3,5-8H2,2H3/b10-9+.
What are the key properties of (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine?
(2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine has a molecular weight of 194.28 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N-ethenyl-4-morpholin-4-ylpenta-2,4-dien-2-amine is sourced from PubChem (CID 126584068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).