5-amino-4-fluoro-2-methoxybenzamide;hydrochloride

C8H10ClFN2O2 — CID 86711464

IUPAC5-amino-4-fluoro-2-methoxybenzamide;hydrochloride
SMILESCOc1cc(F)c(N)cc1C(N)=O.Cl
InChIInChI=1S/C8H9FN2O2.ClH/c1-13-7-3-5(9)6(10)2-4(7)8(11)12;/h2-3H,10H2,1H3,(H2,11,12);1H
InChIKeyRBSDGQJFKNIECW-UHFFFAOYSA-N
MW220.63 g/mol
LogP0.94
Rot. Bonds2

About 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride

5-amino-4-fluoro-2-methoxybenzamide;hydrochloride (PubChem CID 86711464) has the molecular formula C8H10ClFN2O2 and a molecular weight of 220.63 g/mol. Its IUPAC name is 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride.

Molecular Properties

Compound Name5-amino-4-fluoro-2-methoxybenzamide;hydrochloride
PubChem CID86711464
Molecular FormulaC8H10ClFN2O2
Molecular Weight220.63 g/mol
Exact Mass220.04
IUPAC Name5-amino-4-fluoro-2-methoxybenzamide;hydrochloride
SMILESCOc1cc(F)c(N)cc1C(N)=O.Cl
InChIInChI=1S/C8H9FN2O2.ClH/c1-13-7-3-5(9)6(10)2-4(7)8(11)12;/h2-3H,10H2,1H3,(H2,11,12);1H
InChIKeyRBSDGQJFKNIECW-UHFFFAOYSA-N
XLogP0.94
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.63
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-amino-5-fluoro-2-methoxybenzamide
CID 124706175
2,5-dimethoxy-4-methylbenzamide
CID 82491295
2,5-difluoro-4-methoxyaniline
CID 45090681
2-fluoro-4-methoxy-5-methylaniline
CID 89371124
1-(5-amino-2-fluoro-4-methoxyphenyl)-2-bromoethanone
CID 171018288
2-fluoro-5-methoxybenzene-1,4-diamine
CID 107258755
4-chloro-2-methoxybenzamide
CID 19741766
methyl 5-amino-4-fluoro-2-(trifluoromethoxy)benzoate
CID 134645588
4-amino-5-(2-chloroethyl)-2-methoxybenzamide
CID 91050451
4-fluoro-5-[4-(hydroxymethyl)-4-methylcyclohexyl]oxy-2-methoxybenzamide
CID 167110965
2-(4-amino-2-fluoro-5-methoxyphenoxy)benzamide
CID 107259815
5-(2,5-difluoro-4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxamide
CID 116828429

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride?
The IUPAC name of 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride (CID 86711464) is 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride.
What is the SMILES notation for 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride?
The canonical SMILES for 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride is COc1cc(F)c(N)cc1C(N)=O.Cl.
What is the InChIKey of 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride?
The InChIKey is RBSDGQJFKNIECW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2O2.ClH/c1-13-7-3-5(9)6(10)2-4(7)8(11)12;/h2-3H,10H2,1H3,(H2,11,12);1H.
What are the key properties of 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride?
5-amino-4-fluoro-2-methoxybenzamide;hydrochloride has a molecular weight of 220.63 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-fluoro-2-methoxybenzamide;hydrochloride is sourced from PubChem (CID 86711464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).