N'-ethenyl-N-methoxyethanimidamide

C5H10N2O — CID 91299645

IUPACN'-ethenyl-N-methoxyethanimidamide
SMILESC=C/N=C(\C)NOC
InChIInChI=1S/C5H10N2O/c1-4-6-5(2)7-8-3/h4H,1H2,2-3H3,(H,6,7)
InChIKeyMZDFRAWPSKYSDR-UHFFFAOYSA-N
MW114.15 g/mol
LogP0.70
Rot. Bonds2

About N'-ethenyl-N-methoxyethanimidamide

N'-ethenyl-N-methoxyethanimidamide (PubChem CID 91299645) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is N'-ethenyl-N-methoxyethanimidamide.

Molecular Properties

Compound NameN'-ethenyl-N-methoxyethanimidamide
PubChem CID91299645
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC NameN'-ethenyl-N-methoxyethanimidamide
SMILESC=C/N=C(\C)NOC
InChIInChI=1S/C5H10N2O/c1-4-6-5(2)7-8-3/h4H,1H2,2-3H3,(H,6,7)
InChIKeyMZDFRAWPSKYSDR-UHFFFAOYSA-N
XLogP0.70
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-ethenyl-N-methoxy-2-methylpropanimidamide
CID 91490081
methyl (Z)-N-ethenyl-2-methylbut-2-enimidate
CID 143178409
methyl (E)-2-amino-N-ethenylbut-2-enimidate
CID 143656646
4-ethenyliminopent-2-ene-2,3-diamine
CID 152822158
ethane;ethenyl N-ethenylethanimidate
CID 143602013
butane;(2E)-N-methoxypenta-2,4-dien-2-amine
CID 142050769
ethenyl N-methoxycarbamate
CID 59601717
2-amino-N'-ethenyl-3-methylbut-2-enimidamide;ethane;ethene
CID 142067318
(E)-N'-ethenyl-3-fluorobut-2-enimidamide
CID 142337031
ethyl N-ethenylprop-2-enimidate
CID 143813400
(5Z)-N-ethenyl-2-methylhepta-2,5-dien-4-imine
CID 143053895
CID 123399689
CID 123399689

Frequently Asked Questions

What is the IUPAC name of N'-ethenyl-N-methoxyethanimidamide?
The IUPAC name of N'-ethenyl-N-methoxyethanimidamide (CID 91299645) is N'-ethenyl-N-methoxyethanimidamide.
What is the SMILES notation for N'-ethenyl-N-methoxyethanimidamide?
The canonical SMILES for N'-ethenyl-N-methoxyethanimidamide is C=C/N=C(\C)NOC.
What is the InChIKey of N'-ethenyl-N-methoxyethanimidamide?
The InChIKey is MZDFRAWPSKYSDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-4-6-5(2)7-8-3/h4H,1H2,2-3H3,(H,6,7).
What are the key properties of N'-ethenyl-N-methoxyethanimidamide?
N'-ethenyl-N-methoxyethanimidamide has a molecular weight of 114.15 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethenyl-N-methoxyethanimidamide is sourced from PubChem (CID 91299645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).