N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide

C5H7N3 — CID 149183574

IUPACN'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide
SMILESC=C/N=C/N=C/N=C
InChIInChI=1S/C5H7N3/c1-3-7-5-8-4-6-2/h3-5H,1-2H2/b7-5+,8-4+
InChIKeyWSJZHBLMZCIDLO-JBVHCYJISA-N
MW109.13 g/mol
LogP0.89
Rot. Bonds3

About N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide

N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide (PubChem CID 149183574) has the molecular formula C5H7N3 and a molecular weight of 109.13 g/mol. Its IUPAC name is N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide.

Molecular Properties

Compound NameN'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide
PubChem CID149183574
Molecular FormulaC5H7N3
Molecular Weight109.13 g/mol
Exact Mass109.06
IUPAC NameN'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide
SMILESC=C/N=C/N=C/N=C
InChIInChI=1S/C5H7N3/c1-3-7-5-8-4-6-2/h3-5H,1-2H2/b7-5+,8-4+
InChIKeyWSJZHBLMZCIDLO-JBVHCYJISA-N
XLogP0.89
TPSA37.08 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.89
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'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide?
The IUPAC name of N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide (CID 149183574) is N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide.
What is the SMILES notation for N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide?
The canonical SMILES for N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide is C=C/N=C/N=C/N=C.
What is the InChIKey of N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide?
The InChIKey is WSJZHBLMZCIDLO-JBVHCYJISA-N. The full InChI is InChI=1S/C5H7N3/c1-3-7-5-8-4-6-2/h3-5H,1-2H2/b7-5+,8-4+.
What are the key properties of N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide?
N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide has a molecular weight of 109.13 g/mol, XLogP of 0.89, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethenyl-N-[(methylideneamino)methylidene]methanimidamide is sourced from PubChem (CID 149183574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).