5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine

C9H13NO — CID 163864435

IUPAC5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine
SMILESC=CC1=C(/C=C\C)OCNC1
InChIInChI=1S/C9H13NO/c1-3-5-9-8(4-2)6-10-7-11-9/h3-5,10H,2,6-7H2,1H3/b5-3-
InChIKeyPFKDILYMDLXNLV-HYXAFXHYSA-N
MW151.21 g/mol
LogP1.58
Rot. Bonds2

About 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine

5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine (PubChem CID 163864435) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine.

Molecular Properties

Compound Name5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine
PubChem CID163864435
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine
SMILESC=CC1=C(/C=C\C)OCNC1
InChIInChI=1S/C9H13NO/c1-3-5-9-8(4-2)6-10-7-11-9/h3-5,10H,2,6-7H2,1H3/b5-3-
InChIKeyPFKDILYMDLXNLV-HYXAFXHYSA-N
XLogP1.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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

ethane;6-ethenyl-7-[(Z)-prop-1-enyl]-2,3,4,5-tetrahydro-1,4-oxazepine
CID 145208551
5,6-bis[(Z)-prop-1-enyl]-2,3-dihydro-1,4-dioxine
CID 146396950
4,5-bis[(Z)-prop-1-enyl]-2,3-dihydrofuran;ethane
CID 145446824
6-ethenyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran
CID 70273510
4,5-bis(ethenyl)-1,2,3,6-tetrahydropyridine;ethane
CID 144962467
ethane;6-ethenyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,4-oxazine
CID 142875398
6-ethenyl-5-[(Z)-prop-1-enyl]-4H-1,4-oxazin-3-one
CID 134485479
3-methyl-5-[(Z)-prop-1-enyl]-6-[(E)-prop-1-enyl]-3,4-dihydro-2H-pyran
CID 89247388
ethane;1,2,4-tris(ethenyl)-3-[(Z)-prop-1-enyl]cyclopenta-1,3-diene
CID 142480313
4-methyl-5-prop-1-enyl-1,2,3,6-tetrahydropyridine
CID 123515438
5-methylidene-1,3-oxazolidine
CID 70580345
ethane;4-ethenyl-2-methyl-5-[(Z)-prop-1-enyl]-3H-pyrrole
CID 142986985

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine?
The IUPAC name of 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine (CID 163864435) is 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine.
What is the SMILES notation for 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine?
The canonical SMILES for 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine is C=CC1=C(/C=C\C)OCNC1.
What is the InChIKey of 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine?
The InChIKey is PFKDILYMDLXNLV-HYXAFXHYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-5-9-8(4-2)6-10-7-11-9/h3-5,10H,2,6-7H2,1H3/b5-3-.
What are the key properties of 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine?
5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine has a molecular weight of 151.21 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,3-oxazine is sourced from PubChem (CID 163864435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).