(4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone

C14H12FNO — CID 63554344

IUPAC(4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone
SMILESCc1cccc(C(=O)c2ccc(F)cc2C)n1
InChIInChI=1S/C14H12FNO/c1-9-8-11(15)6-7-12(9)14(17)13-5-3-4-10(2)16-13/h3-8H,1-2H3
InChIKeyVAJLKSZZXVLPKU-UHFFFAOYSA-N
MW229.25 g/mol
LogP3.07
Rot. Bonds2

About (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone

(4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone (PubChem CID 63554344) has the molecular formula C14H12FNO and a molecular weight of 229.25 g/mol. Its IUPAC name is (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone.

Molecular Properties

Compound Name(4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone
PubChem CID63554344
Molecular FormulaC14H12FNO
Molecular Weight229.25 g/mol
Exact Mass229.09
IUPAC Name(4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone
SMILESCc1cccc(C(=O)c2ccc(F)cc2C)n1
InChIInChI=1S/C14H12FNO/c1-9-8-11(15)6-7-12(9)14(17)13-5-3-4-10(2)16-13/h3-8H,1-2H3
InChIKeyVAJLKSZZXVLPKU-UHFFFAOYSA-N
XLogP3.07
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methoxy-2,5-dimethylphenyl)-(6-methyl-2-pyridinyl)methanone
CID 113370085
(5-bromo-2-fluorophenyl)-(6-methyl-2-pyridinyl)methanone
CID 79742364
(2,3-dimethylphenyl)-(4-fluoro-2-methylphenyl)methanone
CID 79020544
(4-fluoro-2-methylphenyl)-(2,4,5-trimethylphenyl)methanone
CID 81273528
2-(2,5-difluorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 63556118
(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanone
CID 12739979
(2-amino-5-bromophenyl)-(6-methyl-2-pyridinyl)methanone
CID 125388533
(3-chloro-4-methylphenyl)-(6-methyl-2-pyridinyl)methanone
CID 107559828
(4-fluoro-2-methylphenyl)-(1-phenylpyrazol-3-yl)methanone
CID 105095655
(6-methyl-2-pyridinyl)-[2-(trifluoromethoxy)phenyl]methanone
CID 63553798
6-methylpyridine-2-carbonyl iodide
CID 154552361
1-(4-fluoro-2-methylphenyl)ethanone
CID 3494772

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone?
The IUPAC name of (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone (CID 63554344) is (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone.
What is the SMILES notation for (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone?
The canonical SMILES for (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone is Cc1cccc(C(=O)c2ccc(F)cc2C)n1.
What is the InChIKey of (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone?
The InChIKey is VAJLKSZZXVLPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO/c1-9-8-11(15)6-7-12(9)14(17)13-5-3-4-10(2)16-13/h3-8H,1-2H3.
What are the key properties of (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone?
(4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone has a molecular weight of 229.25 g/mol, XLogP of 3.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-methylphenyl)-(6-methyl-2-pyridinyl)methanone is sourced from PubChem (CID 63554344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).