6-imidazol-1-ylpyridine-2-carboximidamide

C9H9N5 — CID 64595368

IUPAC6-imidazol-1-ylpyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cccc(-n2ccnc2)n1
InChIInChI=1S/C9H9N5/c10-9(11)7-2-1-3-8(13-7)14-5-4-12-6-14/h1-6H,(H3,10,11)
InChIKeyMXKMSPWOFZOARA-UHFFFAOYSA-N
MW187.21 g/mol
LogP0.55
Rot. Bonds2

About 6-imidazol-1-ylpyridine-2-carboximidamide

6-imidazol-1-ylpyridine-2-carboximidamide (PubChem CID 64595368) has the molecular formula C9H9N5 and a molecular weight of 187.21 g/mol. Its IUPAC name is 6-imidazol-1-ylpyridine-2-carboximidamide.

Molecular Properties

Compound Name6-imidazol-1-ylpyridine-2-carboximidamide
PubChem CID64595368
Molecular FormulaC9H9N5
Molecular Weight187.21 g/mol
Exact Mass187.09
IUPAC Name6-imidazol-1-ylpyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cccc(-n2ccnc2)n1
InChIInChI=1S/C9H9N5/c10-9(11)7-2-1-3-8(13-7)14-5-4-12-6-14/h1-6H,(H3,10,11)
InChIKeyMXKMSPWOFZOARA-UHFFFAOYSA-N
XLogP0.55
TPSA80.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.21
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-chloro-6-imidazol-1-ylbenzenecarboximidamide
CID 62495659
2-imidazol-1-ylpyridine-4-carboximidamide
CID 24703180
2-imidazol-1-yl-6-methylpyrimidine-4-carboximidamide
CID 107550765
6-imidazol-1-yl-N-phenylpyridine-2-carboxamide
CID 97260029
6-(3,4,5-trimethylpyrazol-1-yl)pyridine-2-carboximidamide
CID 64595960
3-imidazol-1-ylpyridazine-4-carboximidamide
CID 80513473
6-imidazol-1-yl-N-pyridin-3-ylpyridine-2-carboxamide
CID 166481334
6-ethylpyridine-2-carboximidamide
CID 14253206
4-imidazol-1-yl-2,6-dimethylpyridine-3-carboximidamide
CID 81052434
6-imidazol-1-yl-N-thiophen-2-ylsulfonylpyridine-2-carboxamide
CID 75524742
2-imidazol-1-yl-6-(trifluoromethyl)pyridine
CID 53217359
N-(3,4-difluorophenyl)-6-imidazol-1-ylpyridine-2-carboxamide
CID 166481211

Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-ylpyridine-2-carboximidamide?
The IUPAC name of 6-imidazol-1-ylpyridine-2-carboximidamide (CID 64595368) is 6-imidazol-1-ylpyridine-2-carboximidamide.
What is the SMILES notation for 6-imidazol-1-ylpyridine-2-carboximidamide?
The canonical SMILES for 6-imidazol-1-ylpyridine-2-carboximidamide is [H]/N=C(\N)c1cccc(-n2ccnc2)n1.
What is the InChIKey of 6-imidazol-1-ylpyridine-2-carboximidamide?
The InChIKey is MXKMSPWOFZOARA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5/c10-9(11)7-2-1-3-8(13-7)14-5-4-12-6-14/h1-6H,(H3,10,11).
What are the key properties of 6-imidazol-1-ylpyridine-2-carboximidamide?
6-imidazol-1-ylpyridine-2-carboximidamide has a molecular weight of 187.21 g/mol, XLogP of 0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-ylpyridine-2-carboximidamide is sourced from PubChem (CID 64595368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).