1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone

C8H9FN2O — CID 123947388

IUPAC1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone
SMILESC/N=c1\ccc(F)cn1C(C)=O
InChIInChI=1S/C8H9FN2O/c1-6(12)11-5-7(9)3-4-8(11)10-2/h3-5H,1-2H3/b10-8+
InChIKeyRHXXGLFWPAACFA-CSKARUKUSA-N
MW168.17 g/mol
LogP0.82
Rot. Bonds

About 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone

1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone (PubChem CID 123947388) has the molecular formula C8H9FN2O and a molecular weight of 168.17 g/mol. Its IUPAC name is 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone.

Molecular Properties

Compound Name1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone
PubChem CID123947388
Molecular FormulaC8H9FN2O
Molecular Weight168.17 g/mol
Exact Mass168.07
IUPAC Name1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone
SMILESC/N=c1\ccc(F)cn1C(C)=O
InChIInChI=1S/C8H9FN2O/c1-6(12)11-5-7(9)3-4-8(11)10-2/h3-5H,1-2H3/b10-8+
InChIKeyRHXXGLFWPAACFA-CSKARUKUSA-N
XLogP0.82
TPSA34.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-Fluoro-2,3-dihydro-4h-pyrido[1,2-a]pyrimidin-4-one
CID 129892490
Pyridine, 2-acetylimino-1,2-dihydro-1-methyl-
CID 12496815
2,2,2-trifluoro-N-(1-methylpyridin-2-ylidene)acetamide
CID 10081614
7-Fluoro-4H-pyrido[1,2-a]pyrimidin-4-one
CID 68508522
7-Fluoro-2-methylpyrido[1,2-a]pyrimidin-4-one
CID 130051210
9-Fluoro-4H-pyrido[1,2-a]pyrimidin-4-one
CID 138112753
2-Fluoropyrido[1,2-a]pyrimidin-4-one
CID 141381188
2-(Diethylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
CID 340742
2-Amino-8-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115015289
2-Amino-7-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115015290
3-Fluoro-2-methylpyrido[1,2-a]pyrimidin-4-one
CID 169193918
2-(Dimethylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
CID 12843613

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone?
The IUPAC name of 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone (CID 123947388) is 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone.
What is the SMILES notation for 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone?
The canonical SMILES for 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone is C/N=c1\ccc(F)cn1C(C)=O.
What is the InChIKey of 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone?
The InChIKey is RHXXGLFWPAACFA-CSKARUKUSA-N. The full InChI is InChI=1S/C8H9FN2O/c1-6(12)11-5-7(9)3-4-8(11)10-2/h3-5H,1-2H3/b10-8+.
What are the key properties of 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone?
1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone has a molecular weight of 168.17 g/mol, XLogP of 0.82, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methylimino-1-pyridinyl)ethanone is sourced from PubChem (CID 123947388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).