N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide

C7H5Cl2FN2O — CID 141153784

IUPACN-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ncc(F)c(Cl)c1Cl
InChIInChI=1S/C7H5Cl2FN2O/c1-3(13)12-7-6(9)5(8)4(10)2-11-7/h2H,1H3,(H,11,12,13)
InChIKeyHXXUCNKJAYXPLM-UHFFFAOYSA-N
MW223.03 g/mol
LogP2.49
Rot. Bonds1

About N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide

N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide (PubChem CID 141153784) has the molecular formula C7H5Cl2FN2O and a molecular weight of 223.03 g/mol. Its IUPAC name is N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide
PubChem CID141153784
Molecular FormulaC7H5Cl2FN2O
Molecular Weight223.03 g/mol
Exact Mass221.98
IUPAC NameN-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ncc(F)c(Cl)c1Cl
InChIInChI=1S/C7H5Cl2FN2O/c1-3(13)12-7-6(9)5(8)4(10)2-11-7/h2H,1H3,(H,11,12,13)
InChIKeyHXXUCNKJAYXPLM-UHFFFAOYSA-N
XLogP2.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.03
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide?
The IUPAC name of N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide (CID 141153784) is N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide.
What is the SMILES notation for N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide?
The canonical SMILES for N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide is CC(=O)Nc1ncc(F)c(Cl)c1Cl.
What is the InChIKey of N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide?
The InChIKey is HXXUCNKJAYXPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2FN2O/c1-3(13)12-7-6(9)5(8)4(10)2-11-7/h2H,1H3,(H,11,12,13).
What are the key properties of N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide?
N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide has a molecular weight of 223.03 g/mol, XLogP of 2.49, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichloro-5-fluoro-2-pyridinyl)acetamide is sourced from PubChem (CID 141153784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).