2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride

C8H10ClFN2O — CID 46318425

IUPAC2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1c(F)cccc1OC
InChIInChI=1S/C8H9FN2O.ClH/c1-12-6-4-2-3-5(9)7(6)8(10)11;/h2-4H,1H3,(H3,10,11);1H
InChIKeyOBSRLUKNLBRWQE-UHFFFAOYSA-N
MW204.63 g/mol
LogP1.54
Rot. Bonds2

About 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride

2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride (PubChem CID 46318425) has the molecular formula C8H10ClFN2O and a molecular weight of 204.63 g/mol. Its IUPAC name is 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride.

Molecular Properties

Compound Name2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride
PubChem CID46318425
Molecular FormulaC8H10ClFN2O
Molecular Weight204.63 g/mol
Exact Mass204.05
IUPAC Name2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1c(F)cccc1OC
InChIInChI=1S/C8H9FN2O.ClH/c1-12-6-4-2-3-5(9)7(6)8(10)11;/h2-4H,1H3,(H3,10,11);1H
InChIKeyOBSRLUKNLBRWQE-UHFFFAOYSA-N
XLogP1.54
TPSA59.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.63
LogP ≤ 51.54
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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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride?
The IUPAC name of 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride (CID 46318425) is 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride.
What is the SMILES notation for 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride?
The canonical SMILES for 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1c(F)cccc1OC.
What is the InChIKey of 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride?
The InChIKey is OBSRLUKNLBRWQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2O.ClH/c1-12-6-4-2-3-5(9)7(6)8(10)11;/h2-4H,1H3,(H3,10,11);1H.
What are the key properties of 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride?
2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride has a molecular weight of 204.63 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-methoxybenzenecarboximidamide;hydrochloride is sourced from PubChem (CID 46318425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).