(2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone

C15H15NO2 — CID 105064875

IUPAC(2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone
SMILESCOc1cnccc1C(=O)c1cc(C)ccc1C
InChIInChI=1S/C15H15NO2/c1-10-4-5-11(2)13(8-10)15(17)12-6-7-16-9-14(12)18-3/h4-9H,1-3H3
InChIKeySEBSLFQFEGCMLK-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.94
Rot. Bonds3

About (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone

(2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone (PubChem CID 105064875) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone.

Molecular Properties

Compound Name(2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone
PubChem CID105064875
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name(2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone
SMILESCOc1cnccc1C(=O)c1cc(C)ccc1C
InChIInChI=1S/C15H15NO2/c1-10-4-5-11(2)13(8-10)15(17)12-6-7-16-9-14(12)18-3/h4-9H,1-3H3
InChIKeySEBSLFQFEGCMLK-UHFFFAOYSA-N
XLogP2.94
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-fluoro-2-methylphenyl)-(3-methoxy-4-pyridinyl)methanone
CID 105064925
2-(2-chloro-4-methylphenyl)-1-(3-methoxy-4-pyridinyl)ethanone
CID 106865544
isoquinolin-5-yl-(2-methoxy-5-methylphenyl)methanone
CID 114970995
N-(2-bromo-4,6-dimethylphenyl)-3-methoxypyridine-4-carboxamide
CID 105063604
(3-ethyl-4-pyridinyl)-(2-methoxy-4,6-dimethylphenyl)methanone
CID 106680064
(4-chloro-3-methoxyphenyl)-(2,5-dimethylphenyl)methanone
CID 115781783
(2-chloro-4-methylphenyl)-(4,5-dimethoxy-2-methylphenyl)methanone
CID 106860799
3-hydroxy-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
CID 81442907
(2-methoxy-4,6-dimethylphenyl)-(2-methoxy-5-methylphenyl)methanone
CID 106681983
(2,5-dimethylphenyl)-(2-ethoxy-5-methylphenyl)methanone
CID 63496404
3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
CID 105063330
N-(5-cyano-2-methylphenyl)-3-methoxypyridine-4-carboxamide
CID 105063446

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone?
The IUPAC name of (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone (CID 105064875) is (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone.
What is the SMILES notation for (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone?
The canonical SMILES for (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone is COc1cnccc1C(=O)c1cc(C)ccc1C.
What is the InChIKey of (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone?
The InChIKey is SEBSLFQFEGCMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-10-4-5-11(2)13(8-10)15(17)12-6-7-16-9-14(12)18-3/h4-9H,1-3H3.
What are the key properties of (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone?
(2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone has a molecular weight of 241.29 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylphenyl)-(3-methoxy-4-pyridinyl)methanone is sourced from PubChem (CID 105064875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).