N-(5-chloro-3-fluoro-2-pyridinyl)acetamide

C7H6ClFN2O — CID 58542717

IUPACN-(5-chloro-3-fluoro-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ncc(Cl)cc1F
InChIInChI=1S/C7H6ClFN2O/c1-4(12)11-7-6(9)2-5(8)3-10-7/h2-3H,1H3,(H,10,11,12)
InChIKeyZYLHAMDIDPTGQB-UHFFFAOYSA-N
MW188.59 g/mol
LogP1.83
Rot. Bonds1

About N-(5-chloro-3-fluoro-2-pyridinyl)acetamide

N-(5-chloro-3-fluoro-2-pyridinyl)acetamide (PubChem CID 58542717) has the molecular formula C7H6ClFN2O and a molecular weight of 188.59 g/mol. Its IUPAC name is N-(5-chloro-3-fluoro-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-3-fluoro-2-pyridinyl)acetamide
PubChem CID58542717
Molecular FormulaC7H6ClFN2O
Molecular Weight188.59 g/mol
Exact Mass188.02
IUPAC NameN-(5-chloro-3-fluoro-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ncc(Cl)cc1F
InChIInChI=1S/C7H6ClFN2O/c1-4(12)11-7-6(9)2-5(8)3-10-7/h2-3H,1H3,(H,10,11,12)
InChIKeyZYLHAMDIDPTGQB-UHFFFAOYSA-N
XLogP1.83
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.59
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Acetamidopyridine
CID 72929
2-Acetamido-5-chloropyridine
CID 798653
N-(5-chloropyridin-2-yl)-2-methylpentanamide
CID 2889757
N-(5-chloropyridin-2-yl)cyclopropanecarboxamide
CID 686089
2-Chloro-N-pyridin-2-yl-acetamide
CID 289435
3,5-Dichloro-3-pyridylamine
CID 77886
1-(5-Chloropyridin-2-yl)-3-(4-fluorophenyl)urea
CID 661457
1,3-Bis(5-chloropyridin-2-yl)urea
CID 1077773
N-(5-Chloro-2-pyridinyl)-3-oxobutanamide
CID 811631
1-(5-Chloropyridin-2-yl)-3-(3-fluorophenyl)urea
CID 878391
7-Chloro-1,4-dihydropyrido(2,3-b)pyrazine-2,3-dione
CID 10559853
Urea, 1-(5-chloro-2-pyridyl)-3-methyl-
CID 99418

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-3-fluoro-2-pyridinyl)acetamide?
The IUPAC name of N-(5-chloro-3-fluoro-2-pyridinyl)acetamide (CID 58542717) is N-(5-chloro-3-fluoro-2-pyridinyl)acetamide.
What is the SMILES notation for N-(5-chloro-3-fluoro-2-pyridinyl)acetamide?
The canonical SMILES for N-(5-chloro-3-fluoro-2-pyridinyl)acetamide is CC(=O)Nc1ncc(Cl)cc1F.
What is the InChIKey of N-(5-chloro-3-fluoro-2-pyridinyl)acetamide?
The InChIKey is ZYLHAMDIDPTGQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClFN2O/c1-4(12)11-7-6(9)2-5(8)3-10-7/h2-3H,1H3,(H,10,11,12).
What are the key properties of N-(5-chloro-3-fluoro-2-pyridinyl)acetamide?
N-(5-chloro-3-fluoro-2-pyridinyl)acetamide has a molecular weight of 188.59 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-3-fluoro-2-pyridinyl)acetamide is sourced from PubChem (CID 58542717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).