(5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane

C12H19NO — CID 146475765

IUPAC(5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane
SMILESC=C/C=C1/OCN(C(C)C)C/C1=C/C
InChIInChI=1S/C12H19NO/c1-5-7-12-11(6-2)8-13(9-14-12)10(3)4/h5-7,10H,1,8-9H2,2-4H3/b11-6-,12-7+
InChIKeyIOYNZGXOWFEHQC-TWTKIJFOSA-N
MW193.29 g/mol
LogP2.70
Rot. Bonds2

About (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane

(5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane (PubChem CID 146475765) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane.

Molecular Properties

Compound Name(5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane
PubChem CID146475765
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name(5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane
SMILESC=C/C=C1/OCN(C(C)C)C/C1=C/C
InChIInChI=1S/C12H19NO/c1-5-7-12-11(6-2)8-13(9-14-12)10(3)4/h5-7,10H,1,8-9H2,2-4H3/b11-6-,12-7+
InChIKeyIOYNZGXOWFEHQC-TWTKIJFOSA-N
XLogP2.70
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2E,4Z)-N-ethyl-4-methoxy-N,6,7-trimethylocta-2,4,6-trien-1-amine
CID 54571566
1-[1-(6-Methoxycyclohexa-1,5-dien-1-yl)ethyl]piperidine
CID 89688746
4-methoxy-N-methyl-N-propan-2-ylcyclohexa-2,4-dien-1-amine
CID 123784215
6-[(1Z)-buta-1,3-dienyl]-3-methyl-5-[(Z)-prop-1-enyl]-2,4-dihydro-1,3-oxazine
CID 130413521
(6E)-6-ethylidene-5-methylidene-3-propyl-1,3-oxazinane
CID 132091953
(5Z,6E)-3-cyclohexa-2,4-dien-1-yl-5-ethylidene-6-prop-2-enylidene-1,3-oxazinane
CID 139311618
(6E)-6-[(2Z)-penta-2,4-dienylidene]-5-propan-2-ylidene-1,3-oxazinane
CID 139458884
(3Z)-4-methoxy-N-methyl-2-methylidene-N-propylhexa-3,5-dien-1-amine
CID 139539796
2-cyclohepta-1,4,6-trien-1-yl-1-[(2Z)-2-[(E)-1-methoxyprop-1-enyl]-4-methylpenta-2,4-dienyl]piperidine
CID 142044157
1-(3-Methoxycyclohexa-2,4-dien-1-yl)-4-propylpiperazine
CID 142256402
(6E)-5-methylidene-3-prop-2-enyl-6-prop-2-enylidene-1,3-oxazinane
CID 143479832
ethane;(5Z,6E)-5-ethylidene-3-methyl-6-prop-2-enylidene-1,3-oxazinane
CID 143508035

Frequently Asked Questions

What is the IUPAC name of (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane?
The IUPAC name of (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane (CID 146475765) is (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane.
What is the SMILES notation for (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane?
The canonical SMILES for (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane is C=C/C=C1/OCN(C(C)C)C/C1=C/C.
What is the InChIKey of (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane?
The InChIKey is IOYNZGXOWFEHQC-TWTKIJFOSA-N. The full InChI is InChI=1S/C12H19NO/c1-5-7-12-11(6-2)8-13(9-14-12)10(3)4/h5-7,10H,1,8-9H2,2-4H3/b11-6-,12-7+.
What are the key properties of (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane?
(5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane has a molecular weight of 193.29 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6E)-5-ethylidene-3-propan-2-yl-6-prop-2-enylidene-1,3-oxazinane is sourced from PubChem (CID 146475765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).