6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one

C19H19N3O2 — CID 167175771

IUPAC6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one
SMILESCc1cc(OCc2ncccn2)cc(=O)n1[C@H](C)c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-14-11-17(24-13-18-20-9-6-10-21-18)12-19(23)22(14)15(2)16-7-4-3-5-8-16/h3-12,15H,13H2,1-2H3/t15-/m1/s1
InChIKeyFGWKAOVHWFSMQA-OAHLLOKOSA-N
MW321.38 g/mol
LogP3.14
Rot. Bonds5

About 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one

6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one (PubChem CID 167175771) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one.

Molecular Properties

Compound Name6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one
PubChem CID167175771
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one
SMILESCc1cc(OCc2ncccn2)cc(=O)n1[C@H](C)c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-14-11-17(24-13-18-20-9-6-10-21-18)12-19(23)22(14)15(2)16-7-4-3-5-8-16/h3-12,15H,13H2,1-2H3/t15-/m1/s1
InChIKeyFGWKAOVHWFSMQA-OAHLLOKOSA-N
XLogP3.14
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one?
The IUPAC name of 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one (CID 167175771) is 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one.
What is the SMILES notation for 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one?
The canonical SMILES for 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one is Cc1cc(OCc2ncccn2)cc(=O)n1[C@H](C)c1ccccc1.
What is the InChIKey of 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one?
The InChIKey is FGWKAOVHWFSMQA-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-14-11-17(24-13-18-20-9-6-10-21-18)12-19(23)22(14)15(2)16-7-4-3-5-8-16/h3-12,15H,13H2,1-2H3/t15-/m1/s1.
What are the key properties of 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one?
6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one has a molecular weight of 321.38 g/mol, XLogP of 3.14, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-[(1R)-1-phenylethyl]-4-(pyrimidin-2-ylmethoxy)pyridin-2-one is sourced from PubChem (CID 167175771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).