N'-methyl-N-(methyliminomethylamino)methanimidamide

C4H10N4 — CID 22724569

IUPACN'-methyl-N-(methyliminomethylamino)methanimidamide
SMILESC/N=C/NN/C=N/C
InChIInChI=1S/C4H10N4/c1-5-3-7-8-4-6-2/h3-4H,1-2H3,(H,5,7)(H,6,8)
InChIKeyFXNRKTYVPRRDMZ-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.60
Rot. Bonds3

About N'-methyl-N-(methyliminomethylamino)methanimidamide

N'-methyl-N-(methyliminomethylamino)methanimidamide (PubChem CID 22724569) has the molecular formula C4H10N4 and a molecular weight of 114.15 g/mol. Its IUPAC name is N'-methyl-N-(methyliminomethylamino)methanimidamide.

Molecular Properties

Compound NameN'-methyl-N-(methyliminomethylamino)methanimidamide
PubChem CID22724569
Molecular FormulaC4H10N4
Molecular Weight114.15 g/mol
Exact Mass114.09
IUPAC NameN'-methyl-N-(methyliminomethylamino)methanimidamide
SMILESC/N=C/NN/C=N/C
InChIInChI=1S/C4H10N4/c1-5-3-7-8-4-6-2/h3-4H,1-2H3,(H,5,7)(H,6,8)
InChIKeyFXNRKTYVPRRDMZ-UHFFFAOYSA-N
XLogP-0.60
TPSA48.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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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Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-(methyliminomethylamino)methanimidamide?
The IUPAC name of N'-methyl-N-(methyliminomethylamino)methanimidamide (CID 22724569) is N'-methyl-N-(methyliminomethylamino)methanimidamide.
What is the SMILES notation for N'-methyl-N-(methyliminomethylamino)methanimidamide?
The canonical SMILES for N'-methyl-N-(methyliminomethylamino)methanimidamide is C/N=C/NN/C=N/C.
What is the InChIKey of N'-methyl-N-(methyliminomethylamino)methanimidamide?
The InChIKey is FXNRKTYVPRRDMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N4/c1-5-3-7-8-4-6-2/h3-4H,1-2H3,(H,5,7)(H,6,8).
What are the key properties of N'-methyl-N-(methyliminomethylamino)methanimidamide?
N'-methyl-N-(methyliminomethylamino)methanimidamide has a molecular weight of 114.15 g/mol, XLogP of -0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-(methyliminomethylamino)methanimidamide is sourced from PubChem (CID 22724569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).