4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one

C12H12N2O2 — CID 152538105

IUPAC4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one
SMILESCc1cccnc1COc1cc[nH]c(=O)c1
InChIInChI=1S/C12H12N2O2/c1-9-3-2-5-13-11(9)8-16-10-4-6-14-12(15)7-10/h2-7H,8H2,1H3,(H,14,15)
InChIKeyYKYNZMOGAGFQMQ-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.66
Rot. Bonds3

About 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one

4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one (PubChem CID 152538105) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one
PubChem CID152538105
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one
SMILESCc1cccnc1COc1cc[nH]c(=O)c1
InChIInChI=1S/C12H12N2O2/c1-9-3-2-5-13-11(9)8-16-10-4-6-14-12(15)7-10/h2-7H,8H2,1H3,(H,14,15)
InChIKeyYKYNZMOGAGFQMQ-UHFFFAOYSA-N
XLogP1.66
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-[(3-methyl-2-pyridinyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 114940176
3-methyl-2-[(3-methyl-2-pyridinyl)methoxymethyl]pyridine
CID 142776988
potassium trifluoro-[3-[(3-methyl-2-pyridinyl)methoxy]phenyl]boranuide
CID 115982175
2-amino-5-[(3-methyl-2-pyridinyl)methoxy]benzoic acid
CID 107077008
4-butoxy-1H-pyridin-2-one
CID 58896757
3-methyl-2-[[4-(1,2,3,6-tetrahydropyridin-4-yl)phenoxy]methyl]pyridine
CID 115981883
(1R)-1-[2-fluoro-4-[(3-methyl-2-pyridinyl)methoxy]phenyl]ethanamine
CID 107718507
2-[(2-iodophenoxy)methyl]-3-methylpyridine
CID 112549846
1-[2-[4-(hydroxymethyl)phenyl]ethyl]-4-[(3-methyl-2-pyridinyl)methoxy]pyridin-2-one
CID 67006941
3-[(3-methyl-2-pyridinyl)methoxy]benzenecarboximidamide
CID 112650495
2-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]acetonitrile
CID 112650342
1-[4-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-ol
CID 112650663

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one?
The IUPAC name of 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one (CID 152538105) is 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one.
What is the SMILES notation for 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one?
The canonical SMILES for 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one is Cc1cccnc1COc1cc[nH]c(=O)c1.
What is the InChIKey of 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one?
The InChIKey is YKYNZMOGAGFQMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-9-3-2-5-13-11(9)8-16-10-4-6-14-12(15)7-10/h2-7H,8H2,1H3,(H,14,15).
What are the key properties of 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one?
4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one has a molecular weight of 216.24 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methyl-2-pyridinyl)methoxy]-1H-pyridin-2-one is sourced from PubChem (CID 152538105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).