2,2-difluoro-N-pyridin-3-ylacetamide

C7H6F2N2O — CID 103600571

IUPAC2,2-difluoro-N-pyridin-3-ylacetamide
SMILESO=C(Nc1cccnc1)C(F)F
InChIInChI=1S/C7H6F2N2O/c8-6(9)7(12)11-5-2-1-3-10-4-5/h1-4,6H,(H,11,12)
InChIKeyJTJNNYKFVJNZIX-UHFFFAOYSA-N
MW172.13 g/mol
LogP1.29
Rot. Bonds2

About 2,2-difluoro-N-pyridin-3-ylacetamide

2,2-difluoro-N-pyridin-3-ylacetamide (PubChem CID 103600571) has the molecular formula C7H6F2N2O and a molecular weight of 172.13 g/mol. Its IUPAC name is 2,2-difluoro-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2,2-difluoro-N-pyridin-3-ylacetamide
PubChem CID103600571
Molecular FormulaC7H6F2N2O
Molecular Weight172.13 g/mol
Exact Mass172.04
IUPAC Name2,2-difluoro-N-pyridin-3-ylacetamide
SMILESO=C(Nc1cccnc1)C(F)F
InChIInChI=1S/C7H6F2N2O/c8-6(9)7(12)11-5-2-1-3-10-4-5/h1-4,6H,(H,11,12)
InChIKeyJTJNNYKFVJNZIX-UHFFFAOYSA-N
XLogP1.29
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.13
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-hydroxy-2-phenyl-N-pyridin-3-ylacetamide
CID 118541599
methyl 2-(pyridin-3-ylcarbamoyl)butanoate
CID 115187840
(2S)-2-methoxy-2-phenyl-N-pyridin-3-ylacetamide
CID 51604927
(2R)-2-(4-fluorophenoxy)-N-pyridin-3-ylbutanamide
CID 99131304
pyridin-3-ylthiourea
CID 2760515
2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
CID 177434462
1-pyridin-3-yl-3-[4-[4-(pyridin-3-ylcarbamoylamino)phenyl]phenyl]urea
CID 23996528
boric acid;pyridin-3-ylurea
CID 175497836
N-pyridin-3-ylprop-2-ynamide
CID 130904210
2-(2-fluorophenyl)-N-pyridin-3-ylacetamide
CID 4195275
1-(4-fluoro-2-methylphenyl)-3-pyridin-3-ylurea
CID 47126026
2-(4-chlorophenyl)-3-methyl-N-pyridin-3-ylbutanamide
CID 46226142

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-pyridin-3-ylacetamide?
The IUPAC name of 2,2-difluoro-N-pyridin-3-ylacetamide (CID 103600571) is 2,2-difluoro-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2,2-difluoro-N-pyridin-3-ylacetamide?
The canonical SMILES for 2,2-difluoro-N-pyridin-3-ylacetamide is O=C(Nc1cccnc1)C(F)F.
What is the InChIKey of 2,2-difluoro-N-pyridin-3-ylacetamide?
The InChIKey is JTJNNYKFVJNZIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N2O/c8-6(9)7(12)11-5-2-1-3-10-4-5/h1-4,6H,(H,11,12).
What are the key properties of 2,2-difluoro-N-pyridin-3-ylacetamide?
2,2-difluoro-N-pyridin-3-ylacetamide has a molecular weight of 172.13 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-pyridin-3-ylacetamide is sourced from PubChem (CID 103600571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).