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

C9H13NO — CID 137487544

IUPAC(5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane
SMILESC=C/C=C1/CNCO/C1=C/C
InChIInChI=1S/C9H13NO/c1-3-5-8-6-10-7-11-9(8)4-2/h3-5,10H,1,6-7H2,2H3/b8-5-,9-4+
InChIKeyCKELKJOYNYKLCR-JDNPHIJCSA-N
MW151.21 g/mol
LogP1.58
Rot. Bonds1

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

(5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane (PubChem CID 137487544) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane.

Molecular Properties

Compound Name(5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane
PubChem CID137487544
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name(5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane
SMILESC=C/C=C1/CNCO/C1=C/C
InChIInChI=1S/C9H13NO/c1-3-5-8-6-10-7-11-9(8)4-2/h3-5,10H,1,6-7H2,2H3/b8-5-,9-4+
InChIKeyCKELKJOYNYKLCR-JDNPHIJCSA-N
XLogP1.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3Z,5E)-5-methoxy-N-methyl-2-methylidenehepta-3,5-dien-1-amine
CID 88576747
3,4,6,7-tetrahydro-2H-1,3-benzoxazine
CID 123762032
5,6-bis[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine
CID 134220357
(5Z,6E)-5-ethylidene-6-prop-2-enylidene-1,3-oxazinane
CID 137487501
(6E)-6-[(Z)-but-2-enylidene]-5-methylidene-1,3-oxazinane
CID 138646483
(6E)-6-[(2Z)-penta-2,4-dienylidene]-5-propan-2-ylidene-1,3-oxazinane
CID 139458884
ethane;2-methylidene-4,7-dihydro-3H-cyclohepta[e][1,3]oxazine
CID 142074060
(2E,3E)-2-ethylidene-4-methoxy-N-methylhexa-3,5-dien-1-amine
CID 142152851
(2E,3Z)-2-ethylidene-5-methoxy-N-methylhexa-3,5-dien-1-amine
CID 142207266
ethane;1-(5-methoxycyclohepta-1,4,6-trien-1-yl)-N-methylmethanamine
CID 142253242
(6E)-6-[(Z)-but-2-enylidene]-5-methylidene-1,3-oxazinane;ethane
CID 142277048
(3Z)-5-methoxy-N-methyl-2-methylidenehexa-3,5-dien-1-amine
CID 143258853

Frequently Asked Questions

What is the IUPAC name of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane?
The IUPAC name of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane (CID 137487544) is (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane.
What is the SMILES notation for (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane?
The canonical SMILES for (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane is C=C/C=C1/CNCO/C1=C/C.
What is the InChIKey of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane?
The InChIKey is CKELKJOYNYKLCR-JDNPHIJCSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-5-8-6-10-7-11-9(8)4-2/h3-5,10H,1,6-7H2,2H3/b8-5-,9-4+.
What are the key properties of (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane?
(5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane has a molecular weight of 151.21 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,6E)-6-ethylidene-5-prop-2-enylidene-1,3-oxazinane is sourced from PubChem (CID 137487544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).