N-[(Z)-1-methoxyprop-1-enyl]methanimine

C5H9NO — CID 144898882

IUPACN-[(Z)-1-methoxyprop-1-enyl]methanimine
SMILESC=N/C(=C/C)OC
InChIInChI=1S/C5H9NO/c1-4-5(6-2)7-3/h4H,2H2,1,3H3/b5-4-
InChIKeyXZFUNGWAFRUJAF-PLNGDYQASA-N
MW99.13 g/mol
LogP1.19
Rot. Bonds2

About N-[(Z)-1-methoxyprop-1-enyl]methanimine

N-[(Z)-1-methoxyprop-1-enyl]methanimine (PubChem CID 144898882) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is N-[(Z)-1-methoxyprop-1-enyl]methanimine.

Molecular Properties

Compound NameN-[(Z)-1-methoxyprop-1-enyl]methanimine
PubChem CID144898882
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC NameN-[(Z)-1-methoxyprop-1-enyl]methanimine
SMILESC=N/C(=C/C)OC
InChIInChI=1S/C5H9NO/c1-4-5(6-2)7-3/h4H,2H2,1,3H3/b5-4-
InChIKeyXZFUNGWAFRUJAF-PLNGDYQASA-N
XLogP1.19
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

[(E)-1-methoxyprop-1-enyl]diazene
CID 163432411
methyl 4-[(E)-1-(methylideneamino)prop-1-enoxy]benzoate
CID 145152584
(3Z,5E)-6-methoxy-6-(methylideneamino)hexa-3,5-dienal
CID 143680466
N-(1-methoxyethenyl)methanimine
CID 123326065
ethane;methyl 4-[(E)-1-(methylideneamino)prop-1-enoxy]benzoate
CID 145152583
N-[(E)-but-2-en-2-yl]methanimine;ethane
CID 145473397
[(E)-1,2-bis(methylideneamino)ethenyl] acetate
CID 143985283
N-[(3E,5E)-5-methoxyhepta-1,3,5-trien-4-yl]methanimine
CID 145152774
(Z)-N-[(E)-1-methoxy-3-methyl-2-(methylideneamino)but-1-enyl]ethanimine
CID 171630884
N-[(2Z,4E)-5-methoxyhexa-2,4-dien-2-yl]methanimine
CID 167253000
N-[(2Z)-4-methoxypenta-2,4-dien-2-yl]methanimine
CID 156714992
N-[(2Z,4E)-5-methoxy-4-methylhexa-2,4-dien-2-yl]methanimine
CID 166874510

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-methoxyprop-1-enyl]methanimine?
The IUPAC name of N-[(Z)-1-methoxyprop-1-enyl]methanimine (CID 144898882) is N-[(Z)-1-methoxyprop-1-enyl]methanimine.
What is the SMILES notation for N-[(Z)-1-methoxyprop-1-enyl]methanimine?
The canonical SMILES for N-[(Z)-1-methoxyprop-1-enyl]methanimine is C=N/C(=C/C)OC.
What is the InChIKey of N-[(Z)-1-methoxyprop-1-enyl]methanimine?
The InChIKey is XZFUNGWAFRUJAF-PLNGDYQASA-N. The full InChI is InChI=1S/C5H9NO/c1-4-5(6-2)7-3/h4H,2H2,1,3H3/b5-4-.
What are the key properties of N-[(Z)-1-methoxyprop-1-enyl]methanimine?
N-[(Z)-1-methoxyprop-1-enyl]methanimine has a molecular weight of 99.13 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-methoxyprop-1-enyl]methanimine is sourced from PubChem (CID 144898882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).