5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide

C7H9FN4 — CID 123588784

IUPAC5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide
SMILES[H]/N=c1\ccc(F)cn1/C(N)=N/C
InChIInChI=1S/C7H9FN4/c1-11-7(10)12-4-5(8)2-3-6(12)9/h2-4,9H,1H3,(H2,10,11)/b9-6+
InChIKeyHZOUIUPPEFZDKZ-RMKNXTFCSA-N
MW168.17 g/mol
LogP-0.10
Rot. Bonds

About 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide

5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide (PubChem CID 123588784) has the molecular formula C7H9FN4 and a molecular weight of 168.17 g/mol. Its IUPAC name is 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide.

Molecular Properties

Compound Name5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide
PubChem CID123588784
Molecular FormulaC7H9FN4
Molecular Weight168.17 g/mol
Exact Mass168.08
IUPAC Name5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide
SMILES[H]/N=c1\ccc(F)cn1/C(N)=N/C
InChIInChI=1S/C7H9FN4/c1-11-7(10)12-4-5(8)2-3-6(12)9/h2-4,9H,1H3,(H2,10,11)/b9-6+
InChIKeyHZOUIUPPEFZDKZ-RMKNXTFCSA-N
XLogP-0.10
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-Fluoro-1-methylpyridin-2-imine;hydrobromide
CID 90654292
1-(C,N-dimethylcarbonimidoyl)-5-fluoropyridin-2-imine
CID 89441546
5-Fluoro-1-methylpyridin-2-imine
CID 90654293
1-Ethanimidoyl-5-fluoropyridin-2-imine
CID 123588695
5-fluoro-2-imino-N-methyl-N-propylpyridine-1-carboximidamide
CID 123619854
5-fluoro-2-imino-N,N-di(propan-2-yl)pyridine-1-carboximidamide
CID 123830971
1-(5-fluoro-2-imino-1-pyridinyl)-N,N-dimethylmethanamine
CID 123992421
2-(5-fluoro-2-imino-1-pyridinyl)-2-imino-N,N-dimethylethanamine
CID 129302384
5-fluoro-2-imino-N,N-dimethylpyridine-1-carboximidamide
CID 130313392
N-[2-(dimethylamino)ethyl]-5-fluoro-2-imino-N-methylpyridine-1-carboximidamide
CID 145588305
5-fluoro-2-imino-N'-propan-2-ylpyridine-1-carboximidamide
CID 145588397
5-fluoro-2-imino-N,N-bis(prop-2-enyl)pyridine-1-carboximidamide
CID 145588483

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide?
The IUPAC name of 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide (CID 123588784) is 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide.
What is the SMILES notation for 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide?
The canonical SMILES for 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide is [H]/N=c1\ccc(F)cn1/C(N)=N/C.
What is the InChIKey of 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide?
The InChIKey is HZOUIUPPEFZDKZ-RMKNXTFCSA-N. The full InChI is InChI=1S/C7H9FN4/c1-11-7(10)12-4-5(8)2-3-6(12)9/h2-4,9H,1H3,(H2,10,11)/b9-6+.
What are the key properties of 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide?
5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide has a molecular weight of 168.17 g/mol, XLogP of -0.10, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-imino-N'-methylpyridine-1-carboximidamide is sourced from PubChem (CID 123588784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).