5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one

C18H20N2O5 — CID 27378207

IUPAC5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one
SMILESCOc1ccccc1N1CCN(C(=O)c2cc(=O)c(OC)co2)CC1
InChIInChI=1S/C18H20N2O5/c1-23-15-6-4-3-5-13(15)19-7-9-20(10-8-19)18(22)16-11-14(21)17(24-2)12-25-16/h3-6,11-12H,7-10H2,1-2H3
InChIKeyQGEVRKJMAXGKDE-UHFFFAOYSA-N
MW344.37 g/mol
LogP1.62
Rot. Bonds4

About 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one

5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one (PubChem CID 27378207) has the molecular formula C18H20N2O5 and a molecular weight of 344.37 g/mol. Its IUPAC name is 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one.

Molecular Properties

Compound Name5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one
PubChem CID27378207
Molecular FormulaC18H20N2O5
Molecular Weight344.37 g/mol
Exact Mass344.14
IUPAC Name5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one
SMILESCOc1ccccc1N1CCN(C(=O)c2cc(=O)c(OC)co2)CC1
InChIInChI=1S/C18H20N2O5/c1-23-15-6-4-3-5-13(15)19-7-9-20(10-8-19)18(22)16-11-14(21)17(24-2)12-25-16/h3-6,11-12H,7-10H2,1-2H3
InChIKeyQGEVRKJMAXGKDE-UHFFFAOYSA-N
XLogP1.62
TPSA72.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]phenyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 4116089
[4-(2-methoxyphenyl)piperazin-1-yl]-(2-methyl-1,3-oxazol-4-yl)methanone
CID 30402904
(3,4-dihydroxyphenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 113199237
(2-bromophenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 1049087
(3,5-dichloro-4-methoxyphenyl)-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 9034132
[4-(2-methoxyphenyl)piperazin-1-yl]-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methanone
CID 110393038
(2R)-2-amino-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
CID 15549623
[4-(2-methoxyphenyl)piperazin-1-yl]-(2-propan-2-ylsulfanylphenyl)methanone
CID 17224606
2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-(2-oxo-2-piperidin-1-ylethoxy)pyran-4-one
CID 16802982
4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2H-phthalazin-1-one
CID 2557287
[4-(2-fluorophenyl)piperazin-1-yl]-(7-methoxy-1-benzofuran-2-yl)methanone
CID 6472790
5-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 14053707

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one?
The IUPAC name of 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one (CID 27378207) is 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one.
What is the SMILES notation for 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one?
The canonical SMILES for 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one is COc1ccccc1N1CCN(C(=O)c2cc(=O)c(OC)co2)CC1.
What is the InChIKey of 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one?
The InChIKey is QGEVRKJMAXGKDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5/c1-23-15-6-4-3-5-13(15)19-7-9-20(10-8-19)18(22)16-11-14(21)17(24-2)12-25-16/h3-6,11-12H,7-10H2,1-2H3.
What are the key properties of 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one?
5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one has a molecular weight of 344.37 g/mol, XLogP of 1.62, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[4-(2-methoxyphenyl)piperazine-1-carbonyl]pyran-4-one is sourced from PubChem (CID 27378207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).