2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone

C15H14FNO — CID 79746106

IUPAC2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone
SMILESCCc1ccc(CC(=O)c2ccccc2F)nc1
InChIInChI=1S/C15H14FNO/c1-2-11-7-8-12(17-10-11)9-15(18)13-5-3-4-6-14(13)16/h3-8,10H,2,9H2,1H3
InChIKeyCYNMMNRZTZYYFC-UHFFFAOYSA-N
MW243.28 g/mol
LogP3.21
Rot. Bonds4

About 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone

2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone (PubChem CID 79746106) has the molecular formula C15H14FNO and a molecular weight of 243.28 g/mol. Its IUPAC name is 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone.

Molecular Properties

Compound Name2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone
PubChem CID79746106
Molecular FormulaC15H14FNO
Molecular Weight243.28 g/mol
Exact Mass243.11
IUPAC Name2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone
SMILESCCc1ccc(CC(=O)c2ccccc2F)nc1
InChIInChI=1S/C15H14FNO/c1-2-11-7-8-12(17-10-11)9-15(18)13-5-3-4-6-14(13)16/h3-8,10H,2,9H2,1H3
InChIKeyCYNMMNRZTZYYFC-UHFFFAOYSA-N
XLogP3.21
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.28
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-ethyl-2-pyridinyl)-1-(4-fluoro-2-methylphenyl)ethanone
CID 81273317
2-[(5-ethyl-2-pyridinyl)methyl]benzoic acid
CID 79740576
1-(2,5-dichlorothiophen-3-yl)-2-(5-ethyl-2-pyridinyl)ethanone
CID 114022019
1-(2,3-difluorophenyl)-2-(5-methyl-2-pyridinyl)ethanone
CID 66448501
2-(5-ethyl-2-pyridinyl)-1-quinolin-2-ylethanone
CID 79732159
1-(3-bromophenyl)-2-(5-ethyl-2-pyridinyl)ethanone
CID 79746330
1-(5-ethyl-2-pyridinyl)-3,3-dimethylbutan-2-one
CID 79745157
1-(4-ethoxyphenyl)-2-(5-ethyl-2-pyridinyl)ethanone
CID 115786182
2-[(5-ethyl-2-pyridinyl)methyl]-5-fluorobenzoic acid
CID 79740577
2-(5-ethylthiophen-2-yl)-1-(2-fluorophenyl)ethanone
CID 55181131
1-(5-ethyl-2-pyridinyl)-3-hydroxybutan-2-one
CID 103451397
1-(cyclohexen-1-yl)-2-(5-ethyl-2-pyridinyl)ethanone
CID 103449933

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone?
The IUPAC name of 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone (CID 79746106) is 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone.
What is the SMILES notation for 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone?
The canonical SMILES for 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone is CCc1ccc(CC(=O)c2ccccc2F)nc1.
What is the InChIKey of 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone?
The InChIKey is CYNMMNRZTZYYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO/c1-2-11-7-8-12(17-10-11)9-15(18)13-5-3-4-6-14(13)16/h3-8,10H,2,9H2,1H3.
What are the key properties of 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone?
2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone has a molecular weight of 243.28 g/mol, XLogP of 3.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2-pyridinyl)-1-(2-fluorophenyl)ethanone is sourced from PubChem (CID 79746106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).