(2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone

C14H12FNO2 — CID 105123706

IUPAC(2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone
SMILESCOc1cccc(C(=O)c2cccnc2C)c1F
InChIInChI=1S/C14H12FNO2/c1-9-10(6-4-8-16-9)14(17)11-5-3-7-12(18-2)13(11)15/h3-8H,1-2H3
InChIKeyZLRFSCUCIPGELH-UHFFFAOYSA-N
MW245.25 g/mol
LogP2.77
Rot. Bonds3

About (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone

(2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone (PubChem CID 105123706) has the molecular formula C14H12FNO2 and a molecular weight of 245.25 g/mol. Its IUPAC name is (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone
PubChem CID105123706
Molecular FormulaC14H12FNO2
Molecular Weight245.25 g/mol
Exact Mass245.09
IUPAC Name(2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone
SMILESCOc1cccc(C(=O)c2cccnc2C)c1F
InChIInChI=1S/C14H12FNO2/c1-9-10(6-4-8-16-9)14(17)11-5-3-7-12(18-2)13(11)15/h3-8H,1-2H3
InChIKeyZLRFSCUCIPGELH-UHFFFAOYSA-N
XLogP2.77
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

bis(2-fluoro-3-methoxyphenyl)methanone
CID 70479796
(2-methyl-3-pyridinyl)-[2-(trifluoromethoxy)phenyl]methanone
CID 105094746
(4-bromo-2-fluorophenyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 114905847
2-chloro-2,2-difluoro-1-(2-fluoro-3-methoxyphenyl)ethanone
CID 112575015
methyl 2-methylpyridine-3-carboxylate
CID 7015327
(4-chloro-2-fluorophenyl)-(2-methyl-3-pyridinyl)methanone
CID 105122735
(2-methoxyphenyl)-quinolin-8-ylmethanone
CID 81215631
(3,5-dichloro-2-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 82807772
(2-amino-5-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 90097176
1-(2-fluoro-3-methoxyphenyl)-2,2-dimethylpropan-1-one
CID 82807864
1-(2-fluoro-3-methoxyphenyl)prop-2-en-1-one
CID 103453675
bis(3-methoxy-2-methylphenyl)methanone
CID 139698462

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone?
The IUPAC name of (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone (CID 105123706) is (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone.
What is the SMILES notation for (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone?
The canonical SMILES for (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone is COc1cccc(C(=O)c2cccnc2C)c1F.
What is the InChIKey of (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone?
The InChIKey is ZLRFSCUCIPGELH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO2/c1-9-10(6-4-8-16-9)14(17)11-5-3-7-12(18-2)13(11)15/h3-8H,1-2H3.
What are the key properties of (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone?
(2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone has a molecular weight of 245.25 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-3-methoxyphenyl)-(2-methyl-3-pyridinyl)methanone is sourced from PubChem (CID 105123706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).