N'-methyl-N-prop-2-enylidenemethanimidamide

C5H8N2 — CID 123318628

IUPACN'-methyl-N-prop-2-enylidenemethanimidamide
SMILESC=C/C=N/C=N/C
InChIInChI=1S/C5H8N2/c1-3-4-7-5-6-2/h3-5H,1H2,2H3/b6-5+,7-4+
InChIKeyFMAYBGUVVRNKBR-HVUXDCMCSA-N
MW96.13 g/mol
LogP0.90
Rot. Bonds2

About N'-methyl-N-prop-2-enylidenemethanimidamide

N'-methyl-N-prop-2-enylidenemethanimidamide (PubChem CID 123318628) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is N'-methyl-N-prop-2-enylidenemethanimidamide.

Molecular Properties

Compound NameN'-methyl-N-prop-2-enylidenemethanimidamide
PubChem CID123318628
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC NameN'-methyl-N-prop-2-enylidenemethanimidamide
SMILESC=C/C=N/C=N/C
InChIInChI=1S/C5H8N2/c1-3-4-7-5-6-2/h3-5H,1H2,2H3/b6-5+,7-4+
InChIKeyFMAYBGUVVRNKBR-HVUXDCMCSA-N
XLogP0.90
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-prop-2-enylidenemethanimidamide?
The IUPAC name of N'-methyl-N-prop-2-enylidenemethanimidamide (CID 123318628) is N'-methyl-N-prop-2-enylidenemethanimidamide.
What is the SMILES notation for N'-methyl-N-prop-2-enylidenemethanimidamide?
The canonical SMILES for N'-methyl-N-prop-2-enylidenemethanimidamide is C=C/C=N/C=N/C.
What is the InChIKey of N'-methyl-N-prop-2-enylidenemethanimidamide?
The InChIKey is FMAYBGUVVRNKBR-HVUXDCMCSA-N. The full InChI is InChI=1S/C5H8N2/c1-3-4-7-5-6-2/h3-5H,1H2,2H3/b6-5+,7-4+.
What are the key properties of N'-methyl-N-prop-2-enylidenemethanimidamide?
N'-methyl-N-prop-2-enylidenemethanimidamide has a molecular weight of 96.13 g/mol, XLogP of 0.90, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-prop-2-enylidenemethanimidamide is sourced from PubChem (CID 123318628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).