6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one

C20H20N2O2 — CID 169227224

IUPAC6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one
SMILESCc1cccc(OCc2ccc(Cn3c(C)cccc3=O)cc2)n1
InChIInChI=1S/C20H20N2O2/c1-15-5-3-7-19(21-15)24-14-18-11-9-17(10-12-18)13-22-16(2)6-4-8-20(22)23/h3-12H,13-14H2,1-2H3
InChIKeyZNNPYKXIIINJOB-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.49
Rot. Bonds5

About 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one

6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one (PubChem CID 169227224) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one.

Molecular Properties

Compound Name6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one
PubChem CID169227224
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one
SMILESCc1cccc(OCc2ccc(Cn3c(C)cccc3=O)cc2)n1
InChIInChI=1S/C20H20N2O2/c1-15-5-3-7-19(21-15)24-14-18-11-9-17(10-12-18)13-22-16(2)6-4-8-20(22)23/h3-12H,13-14H2,1-2H3
InChIKeyZNNPYKXIIINJOB-UHFFFAOYSA-N
XLogP3.49
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-benzyl-2-methyl-6-phenylmethoxypyrimidin-4-one;ethane
CID 91343480
4-[(6-methyl-2-pyridinyl)oxymethyl]-1H-pyridin-2-one
CID 175949768
N-[2-[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]ethylidene]hydroxylamine
CID 173145448
ethane;1-[(6-methyl-2-pyridinyl)oxy]pyridin-2-one
CID 168939177
1-[(3-bromo-4-methoxyphenyl)methyl]-6-methylpyridin-2-one
CID 54970751
2-methyl-6-(pyridin-2-ylmethoxy)pyridine
CID 86815736
2-(methoxymethoxy)-6-methylpyridine
CID 150228028
1-(methoxymethyl)-6-methylpyridin-2-one
CID 14787165
1-(2-bromoethyl)-6-methylpyridin-2-one
CID 60876418
5-[(6-bromo-2-pyridinyl)oxymethyl]-1-methylpyridin-2-one
CID 171628394
3-(2,6-dichlorophenyl)-2-methyl-6-phenylmethoxypyrimidin-4-one
CID 21090100
2-[(6-methyl-2-pyridinyl)oxy]acetamide
CID 22228306

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one?
The IUPAC name of 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one (CID 169227224) is 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one.
What is the SMILES notation for 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one?
The canonical SMILES for 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one is Cc1cccc(OCc2ccc(Cn3c(C)cccc3=O)cc2)n1.
What is the InChIKey of 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one?
The InChIKey is ZNNPYKXIIINJOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-15-5-3-7-19(21-15)24-14-18-11-9-17(10-12-18)13-22-16(2)6-4-8-20(22)23/h3-12H,13-14H2,1-2H3.
What are the key properties of 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one?
6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one has a molecular weight of 320.39 g/mol, XLogP of 3.49, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-[[4-[(6-methyl-2-pyridinyl)oxymethyl]phenyl]methyl]pyridin-2-one is sourced from PubChem (CID 169227224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).