7-fluoroquinoline-4-carboximidamide

C10H8FN3 — CID 83677826

IUPAC7-fluoroquinoline-4-carboximidamide
SMILES[H]/N=C(\N)c1ccnc2cc(F)ccc12
InChIInChI=1S/C10H8FN3/c11-6-1-2-7-8(10(12)13)3-4-14-9(7)5-6/h1-5H,(H3,12,13)
InChIKeyCOIDBLLWQOIUFT-UHFFFAOYSA-N
MW189.19 g/mol
LogP1.66
Rot. Bonds1

About 7-fluoroquinoline-4-carboximidamide

7-fluoroquinoline-4-carboximidamide (PubChem CID 83677826) has the molecular formula C10H8FN3 and a molecular weight of 189.19 g/mol. Its IUPAC name is 7-fluoroquinoline-4-carboximidamide.

Molecular Properties

Compound Name7-fluoroquinoline-4-carboximidamide
PubChem CID83677826
Molecular FormulaC10H8FN3
Molecular Weight189.19 g/mol
Exact Mass189.07
IUPAC Name7-fluoroquinoline-4-carboximidamide
SMILES[H]/N=C(\N)c1ccnc2cc(F)ccc12
InChIInChI=1S/C10H8FN3/c11-6-1-2-7-8(10(12)13)3-4-14-9(7)5-6/h1-5H,(H3,12,13)
InChIKeyCOIDBLLWQOIUFT-UHFFFAOYSA-N
XLogP1.66
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.19
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

7-fluoroquinoline-4-carboxylic acid
CID 18475507
6-methylquinoline-4-carboximidamide
CID 83677821
2-chloro-4-fluorobenzenecarboximidamide
CID 3626359
2-amino-4-fluorobenzenecarboximidamide
CID 140514748
7-fluoro-4-iodoquinoline
CID 118066569
ethane;2-methyl-1H-pyrrolo[2,3-b]pyridine-4-carboximidamide
CID 144934720
2-(difluoromethyl)-1H-pyrrolo[2,3-b]pyridine-4-carboximidamide;dihydrochloride
CID 118224918
ethane;7-fluoro-4-methylquinoline
CID 142037193
3-chloro-2-(3-fluorophenoxy)pyridine-4-carboximidamide
CID 107060457
7-fluoroisoquinoline-5-carboximidamide
CID 82573360
4-fluorobenzenecarboximidamide;hydroiodide
CID 68780775
7-amino-N'-diazenylquinoline-4-carboximidamide
CID 137149705

Frequently Asked Questions

What is the IUPAC name of 7-fluoroquinoline-4-carboximidamide?
The IUPAC name of 7-fluoroquinoline-4-carboximidamide (CID 83677826) is 7-fluoroquinoline-4-carboximidamide.
What is the SMILES notation for 7-fluoroquinoline-4-carboximidamide?
The canonical SMILES for 7-fluoroquinoline-4-carboximidamide is [H]/N=C(\N)c1ccnc2cc(F)ccc12.
What is the InChIKey of 7-fluoroquinoline-4-carboximidamide?
The InChIKey is COIDBLLWQOIUFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3/c11-6-1-2-7-8(10(12)13)3-4-14-9(7)5-6/h1-5H,(H3,12,13).
What are the key properties of 7-fluoroquinoline-4-carboximidamide?
7-fluoroquinoline-4-carboximidamide has a molecular weight of 189.19 g/mol, XLogP of 1.66, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoroquinoline-4-carboximidamide is sourced from PubChem (CID 83677826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).