N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine

C7H10N2O — CID 164919011

IUPACN-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine
SMILESC=CC1=C(N=C)OCCN1
InChIInChI=1S/C7H10N2O/c1-3-6-7(8-2)10-5-4-9-6/h3,9H,1-2,4-5H2
InChIKeyULPGFBAGBQJICE-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.66
Rot. Bonds2

About N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine

N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine (PubChem CID 164919011) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine.

Molecular Properties

Compound NameN-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine
PubChem CID164919011
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC NameN-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine
SMILESC=CC1=C(N=C)OCCN1
InChIInChI=1S/C7H10N2O/c1-3-6-7(8-2)10-5-4-9-6/h3,9H,1-2,4-5H2
InChIKeyULPGFBAGBQJICE-UHFFFAOYSA-N
XLogP0.66
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

5,6-bis(ethenyl)-1,2,3,4-tetrahydropyrazine
CID 143140752
(1E)-1-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)buta-1,3-dien-1-amine
CID 167072784
ethane;6-ethenyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-1,4-oxazine
CID 142875398
2-(2-methylpropylidene)-1,3-oxazolidine
CID 174399163
ethane;N-(5-ethenyl-2,3-dihydro-1H-pyrrol-4-yl)ethanimine
CID 142623943
2-(pyrrolidin-1-ylmethylidene)-1,3-oxazolidine
CID 174864326
1,3-oxazolidin-2-one;hydrate
CID 141149411
1,3-oxazolidin-2-one;stannane
CID 173239925
5,6-bis(ethenyl)-1,2,3,4-tetrahydropyrimidine
CID 142065982
(2E)-2-benzylidene-1,3-oxazolidine
CID 102070685
ethane;6-ethenyl-7-[(Z)-prop-1-enyl]-2,3,4,5-tetrahydro-1,4-oxazepine
CID 145208551
6-ethenyl-5-prop-1-en-2-yl-1,2,3,4-tetrahydropyridine
CID 153340913

Frequently Asked Questions

What is the IUPAC name of N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine?
The IUPAC name of N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine (CID 164919011) is N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine.
What is the SMILES notation for N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine?
The canonical SMILES for N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine is C=CC1=C(N=C)OCCN1.
What is the InChIKey of N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine?
The InChIKey is ULPGFBAGBQJICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-3-6-7(8-2)10-5-4-9-6/h3,9H,1-2,4-5H2.
What are the key properties of N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine?
N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine has a molecular weight of 138.17 g/mol, XLogP of 0.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethenyl-3,4-dihydro-2H-1,4-oxazin-6-yl)methanimine is sourced from PubChem (CID 164919011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).