N'-diazenyl-N-iminoethanimidamide

C2H5N5 — CID 172971684

IUPACN'-diazenyl-N-iminoethanimidamide
SMILES[H]/N=N/N=C(C)\N=N\[H]
InChIInChI=1S/C2H5N5/c1-2(5-3)6-7-4/h3-4H,1H3/b5-3+,6-2-,7-4+
InChIKeyBHIRCICRAPBOAR-FNPWYDCCSA-N
MW99.10 g/mol
LogP1.38
Rot. Bonds1

About N'-diazenyl-N-iminoethanimidamide

N'-diazenyl-N-iminoethanimidamide (PubChem CID 172971684) has the molecular formula C2H5N5 and a molecular weight of 99.10 g/mol. Its IUPAC name is N'-diazenyl-N-iminoethanimidamide.

Molecular Properties

Compound NameN'-diazenyl-N-iminoethanimidamide
PubChem CID172971684
Molecular FormulaC2H5N5
Molecular Weight99.10 g/mol
Exact Mass99.05
IUPAC NameN'-diazenyl-N-iminoethanimidamide
SMILES[H]/N=N/N=C(C)\N=N\[H]
InChIInChI=1S/C2H5N5/c1-2(5-3)6-7-4/h3-4H,1H3/b5-3+,6-2-,7-4+
InChIKeyBHIRCICRAPBOAR-FNPWYDCCSA-N
XLogP1.38
TPSA84.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.10
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'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-diazenylpropan-2-imine
CID 123232444
diazenyldiazene
CID 19878547
methyl N'-diazenylcarbamimidate
CID 135626895
N'-diazenyl-N,N-dimethylpropanimidamide
CID 166971324
N-iminonitrous amide
CID 57429254
N'-diazenylpentanimidamide
CID 143625651
1,3-diiminothiourea
CID 23135884
N-imino-4-oxopentanamide
CID 59086798
O-methyl N-iminocarbamothioate
CID 141030958
(E)-diazenyl-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-diazenyldiazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazene
CID 140520821
(E)-bis[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-diazenyldiazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazene
CID 23543884
[(E)-1-methoxyprop-1-enyl]diazene
CID 163432411

Frequently Asked Questions

What is the IUPAC name of N'-diazenyl-N-iminoethanimidamide?
The IUPAC name of N'-diazenyl-N-iminoethanimidamide (CID 172971684) is N'-diazenyl-N-iminoethanimidamide.
What is the SMILES notation for N'-diazenyl-N-iminoethanimidamide?
The canonical SMILES for N'-diazenyl-N-iminoethanimidamide is [H]/N=N/N=C(C)\N=N\[H].
What is the InChIKey of N'-diazenyl-N-iminoethanimidamide?
The InChIKey is BHIRCICRAPBOAR-FNPWYDCCSA-N. The full InChI is InChI=1S/C2H5N5/c1-2(5-3)6-7-4/h3-4H,1H3/b5-3+,6-2-,7-4+.
What are the key properties of N'-diazenyl-N-iminoethanimidamide?
N'-diazenyl-N-iminoethanimidamide has a molecular weight of 99.10 g/mol, XLogP of 1.38, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-diazenyl-N-iminoethanimidamide is sourced from PubChem (CID 172971684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).