2-chloro-4-fluoro-3-methoxybenzamide

C8H7ClFNO2 — CID 163198226

IUPAC2-chloro-4-fluoro-3-methoxybenzamide
SMILESCOc1c(F)ccc(C(N)=O)c1Cl
InChIInChI=1S/C8H7ClFNO2/c1-13-7-5(10)3-2-4(6(7)9)8(11)12/h2-3H,1H3,(H2,11,12)
InChIKeyORKAKWCUYIIGPE-UHFFFAOYSA-N
MW203.60 g/mol
LogP1.59
Rot. Bonds2

About 2-chloro-4-fluoro-3-methoxybenzamide

2-chloro-4-fluoro-3-methoxybenzamide (PubChem CID 163198226) has the molecular formula C8H7ClFNO2 and a molecular weight of 203.60 g/mol. Its IUPAC name is 2-chloro-4-fluoro-3-methoxybenzamide.

Molecular Properties

Compound Name2-chloro-4-fluoro-3-methoxybenzamide
PubChem CID163198226
Molecular FormulaC8H7ClFNO2
Molecular Weight203.60 g/mol
Exact Mass203.01
IUPAC Name2-chloro-4-fluoro-3-methoxybenzamide
SMILESCOc1c(F)ccc(C(N)=O)c1Cl
InChIInChI=1S/C8H7ClFNO2/c1-13-7-5(10)3-2-4(6(7)9)8(11)12/h2-3H,1H3,(H2,11,12)
InChIKeyORKAKWCUYIIGPE-UHFFFAOYSA-N
XLogP1.59
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.60
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N,N-diethyl-4-fluoro-3-methoxybenzamide
CID 162421154
4-chloro-2-methoxybenzamide
CID 19741766
1-(2-chloro-4-fluoro-3-methoxyphenyl)propan-2-one
CID 54232083
3-amino-1-(3-chloro-4-fluoro-2-methoxyphenyl)propan-1-one
CID 117335331
2-chloro-3-methoxyterephthalic acid
CID 126601706
(2-chloro-4-fluoro-3-methoxyphenyl)methanol
CID 171005170
3-amino-1-(4-fluoro-2,3-dimethoxyphenyl)propan-1-one
CID 117326576
3-(1-amino-1-oxobutan-2-yl)-2-chloro-4-fluorobenzamide
CID 91612767
1-(2-chloro-3-ethoxy-4-fluorophenyl)ethanone
CID 171005984
1-(4-amino-2-chloro-3-methoxyphenyl)ethanone
CID 171022302
1-(2-bromo-4-fluoro-3-methoxyphenyl)ethanone
CID 171005543
2-chloro-5-fluoro-3-methoxybenzamide
CID 171005053

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-fluoro-3-methoxybenzamide?
The IUPAC name of 2-chloro-4-fluoro-3-methoxybenzamide (CID 163198226) is 2-chloro-4-fluoro-3-methoxybenzamide.
What is the SMILES notation for 2-chloro-4-fluoro-3-methoxybenzamide?
The canonical SMILES for 2-chloro-4-fluoro-3-methoxybenzamide is COc1c(F)ccc(C(N)=O)c1Cl.
What is the InChIKey of 2-chloro-4-fluoro-3-methoxybenzamide?
The InChIKey is ORKAKWCUYIIGPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClFNO2/c1-13-7-5(10)3-2-4(6(7)9)8(11)12/h2-3H,1H3,(H2,11,12).
What are the key properties of 2-chloro-4-fluoro-3-methoxybenzamide?
2-chloro-4-fluoro-3-methoxybenzamide has a molecular weight of 203.60 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-fluoro-3-methoxybenzamide is sourced from PubChem (CID 163198226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).