4-chloro-3-fluorobenzamide;hydrochloride

C7H6Cl2FNO — CID 157022559

IUPAC4-chloro-3-fluorobenzamide;hydrochloride
SMILESCl.NC(=O)c1ccc(Cl)c(F)c1
InChIInChI=1S/C7H5ClFNO.ClH/c8-5-2-1-4(7(10)11)3-6(5)9;/h1-3H,(H2,10,11);1H
InChIKeyKFENWYZOOCIUOQ-UHFFFAOYSA-N
MW210.04 g/mol
LogP2.00
Rot. Bonds1

About 4-chloro-3-fluorobenzamide;hydrochloride

4-chloro-3-fluorobenzamide;hydrochloride (PubChem CID 157022559) has the molecular formula C7H6Cl2FNO and a molecular weight of 210.04 g/mol. Its IUPAC name is 4-chloro-3-fluorobenzamide;hydrochloride.

Molecular Properties

Compound Name4-chloro-3-fluorobenzamide;hydrochloride
PubChem CID157022559
Molecular FormulaC7H6Cl2FNO
Molecular Weight210.04 g/mol
Exact Mass208.98
IUPAC Name4-chloro-3-fluorobenzamide;hydrochloride
SMILESCl.NC(=O)c1ccc(Cl)c(F)c1
InChIInChI=1S/C7H5ClFNO.ClH/c8-5-2-1-4(7(10)11)3-6(5)9;/h1-3H,(H2,10,11);1H
InChIKeyKFENWYZOOCIUOQ-UHFFFAOYSA-N
XLogP2.00
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.04
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-bis(4-chloro-3-fluorophenyl)ethane-1,2-dione
CID 22574248
4-chloro-3-fluorobenzoic acid
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4-(5-amino-2-chloroanilino)-3-fluorobenzamide
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2-[(2-amino-2-oxoethyl)-(4-chloro-3-fluorobenzoyl)amino]acetic acid
CID 107998136
3-chloro-4-hydroxybenzamide
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4-chloro(13C)benzamide
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4-chlorobenzamide
CID 12084
4-bromo-3-chloro-5-fluorobenzamide
CID 130977761
1-(4-chloro-3-fluorophenyl)but-2-en-1-one
CID 162367029
1-(4-chloro-3-fluorophenyl)butan-1-one
CID 70297429
3-[(4-chloro-3-fluoroanilino)methyl]benzamide
CID 61467366
3-chloro-4-iodobenzamide
CID 94675118

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-fluorobenzamide;hydrochloride?
The IUPAC name of 4-chloro-3-fluorobenzamide;hydrochloride (CID 157022559) is 4-chloro-3-fluorobenzamide;hydrochloride.
What is the SMILES notation for 4-chloro-3-fluorobenzamide;hydrochloride?
The canonical SMILES for 4-chloro-3-fluorobenzamide;hydrochloride is Cl.NC(=O)c1ccc(Cl)c(F)c1.
What is the InChIKey of 4-chloro-3-fluorobenzamide;hydrochloride?
The InChIKey is KFENWYZOOCIUOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClFNO.ClH/c8-5-2-1-4(7(10)11)3-6(5)9;/h1-3H,(H2,10,11);1H.
What are the key properties of 4-chloro-3-fluorobenzamide;hydrochloride?
4-chloro-3-fluorobenzamide;hydrochloride has a molecular weight of 210.04 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-fluorobenzamide;hydrochloride is sourced from PubChem (CID 157022559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).