N-(1-cyclopropylethenoxy)methanimine

C6H9NO — CID 146183515

IUPACN-(1-cyclopropylethenoxy)methanimine
SMILESC=NOC(=C)C1CC1
InChIInChI=1S/C6H9NO/c1-5(8-7-2)6-3-4-6/h6H,1-4H2
InChIKeyUNYBVUDPFNTMMF-UHFFFAOYSA-N
MW111.14 g/mol
LogP1.54
Rot. Bonds3

About N-(1-cyclopropylethenoxy)methanimine

N-(1-cyclopropylethenoxy)methanimine (PubChem CID 146183515) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is N-(1-cyclopropylethenoxy)methanimine.

Molecular Properties

Compound NameN-(1-cyclopropylethenoxy)methanimine
PubChem CID146183515
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC NameN-(1-cyclopropylethenoxy)methanimine
SMILESC=NOC(=C)C1CC1
InChIInChI=1S/C6H9NO/c1-5(8-7-2)6-3-4-6/h6H,1-4H2
InChIKeyUNYBVUDPFNTMMF-UHFFFAOYSA-N
XLogP1.54
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.14
LogP ≤ 51.54
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'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[1-[1-(4-hydroxycyclohexyl)ethenoxy]ethenyl]cyclohexan-1-ol
CID 67790517
3-(methylideneamino)oxybut-3-en-2-one
CID 144823891
methyl N'-(1-cyclopropylethenyl)carbamimidate
CID 155009487
1-ethyl-4-(1-pentoxyethenyl)cyclohexane
CID 140668571
1-(methoxymethyl)-4-[1-(4-prop-1-en-2-ylcyclohexyl)ethenoxymethyl]cyclohexane
CID 89187002
1-cyclopropylethenethiol
CID 143525795
CID 59967661
CID 59967661
1-(1-cyclopropylethenoxy)-3-methylbutan-2-one
CID 158298663
N-(1-cyclohexylethenyl)methanimine
CID 123927347
1-(4-bromocyclohexyl)ethenamine
CID 130195147
N'-hydroxycyclopropanecarboximidamide;hydrochloride
CID 53395019
4-(1-aminoethenyl)cyclohexane-1-carboxylic acid
CID 134396570

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethenoxy)methanimine?
The IUPAC name of N-(1-cyclopropylethenoxy)methanimine (CID 146183515) is N-(1-cyclopropylethenoxy)methanimine.
What is the SMILES notation for N-(1-cyclopropylethenoxy)methanimine?
The canonical SMILES for N-(1-cyclopropylethenoxy)methanimine is C=NOC(=C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethenoxy)methanimine?
The InChIKey is UNYBVUDPFNTMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO/c1-5(8-7-2)6-3-4-6/h6H,1-4H2.
What are the key properties of N-(1-cyclopropylethenoxy)methanimine?
N-(1-cyclopropylethenoxy)methanimine has a molecular weight of 111.14 g/mol, XLogP of 1.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethenoxy)methanimine is sourced from PubChem (CID 146183515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).