4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one

C22H24N4O3 — CID 135762492

IUPAC4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one
SMILESCOc1cccc(-c2cc(=O)[nH]c(N3CCN(c4ccccc4OC)CC3)n2)c1
InChIInChI=1S/C22H24N4O3/c1-28-17-7-5-6-16(14-17)18-15-21(27)24-22(23-18)26-12-10-25(11-13-26)19-8-3-4-9-20(19)29-2/h3-9,14-15H,10-13H2,1-2H3,(H,23,24,27)
InChIKeyFAWZOTSGPWYCDD-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.78
Rot. Bonds5

About 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one

4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one (PubChem CID 135762492) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one
PubChem CID135762492
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC Name4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one
SMILESCOc1cccc(-c2cc(=O)[nH]c(N3CCN(c4ccccc4OC)CC3)n2)c1
InChIInChI=1S/C22H24N4O3/c1-28-17-7-5-6-16(14-17)18-15-21(27)24-22(23-18)26-12-10-25(11-13-26)19-8-3-4-9-20(19)29-2/h3-9,14-15H,10-13H2,1-2H3,(H,23,24,27)
InChIKeyFAWZOTSGPWYCDD-UHFFFAOYSA-N
XLogP2.78
TPSA70.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(2-methoxyphenyl)piperazin-1-yl]-4-methyl-1H-pyrimidin-6-one
CID 135465183
4-tert-butyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one
CID 135644971
4-(4-methoxyphenyl)-2-(4-phenylpiperazin-1-yl)-1H-pyrimidin-6-one
CID 135520797
2-[4-(5-methoxy-1H-indol-3-yl)piperazin-1-yl]-4-pyridin-4-yl-1H-pyrimidin-6-one
CID 135453392
4-(4-methoxyphenyl)-2-piperazin-1-yl-1H-pyrimidin-6-one
CID 136923018
[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 4244399
[3-(3-methoxyphenyl)-1-phenylpyrazol-5-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 4046397
4-(3-methylphenyl)-2-pyrrolidin-1-yl-1H-pyrimidin-6-one
CID 136741001
6-(3-methoxyphenyl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]pyridazin-3-one
CID 52902771
2-(4-acetylpiperazin-1-yl)-4-phenyl-1H-pyrimidin-6-one
CID 136780047
4-(3-methoxyphenyl)-2-methylsulfanyl-1H-pyrimidin-6-one
CID 137025507
1-(2-methoxyphenyl)-7-(3-methoxyphenyl)-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one
CID 29090468

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one?
The IUPAC name of 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one (CID 135762492) is 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one?
The canonical SMILES for 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one is COc1cccc(-c2cc(=O)[nH]c(N3CCN(c4ccccc4OC)CC3)n2)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one?
The InChIKey is FAWZOTSGPWYCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-28-17-7-5-6-16(14-17)18-15-21(27)24-22(23-18)26-12-10-25(11-13-26)19-8-3-4-9-20(19)29-2/h3-9,14-15H,10-13H2,1-2H3,(H,23,24,27).
What are the key properties of 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one?
4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one has a molecular weight of 392.46 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyrimidin-6-one is sourced from PubChem (CID 135762492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).