[4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone

C22H20N2O4 — CID 2218605

IUPAC[4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone
SMILESO=C(c1ccco1)N1CCN(C(=O)c2ccccc2Oc2ccccc2)CC1
InChIInChI=1S/C22H20N2O4/c25-21(18-9-4-5-10-19(18)28-17-7-2-1-3-8-17)23-12-14-24(15-13-23)22(26)20-11-6-16-27-20/h1-11,16H,12-15H2
InChIKeyLAWWQCWLMYQWDE-UHFFFAOYSA-N
MW376.41 g/mol
LogP3.67
Rot. Bonds4

About [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone

[4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone (PubChem CID 2218605) has the molecular formula C22H20N2O4 and a molecular weight of 376.41 g/mol. Its IUPAC name is [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone.

Molecular Properties

Compound Name[4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone
PubChem CID2218605
Molecular FormulaC22H20N2O4
Molecular Weight376.41 g/mol
Exact Mass376.14
IUPAC Name[4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone
SMILESO=C(c1ccco1)N1CCN(C(=O)c2ccccc2Oc2ccccc2)CC1
InChIInChI=1S/C22H20N2O4/c25-21(18-9-4-5-10-19(18)28-17-7-2-1-3-8-17)23-12-14-24(15-13-23)22(26)20-11-6-16-27-20/h1-11,16H,12-15H2
InChIKeyLAWWQCWLMYQWDE-UHFFFAOYSA-N
XLogP3.67
TPSA62.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone?
The IUPAC name of [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone (CID 2218605) is [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone.
What is the SMILES notation for [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone?
The canonical SMILES for [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone is O=C(c1ccco1)N1CCN(C(=O)c2ccccc2Oc2ccccc2)CC1.
What is the InChIKey of [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone?
The InChIKey is LAWWQCWLMYQWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4/c25-21(18-9-4-5-10-19(18)28-17-7-2-1-3-8-17)23-12-14-24(15-13-23)22(26)20-11-6-16-27-20/h1-11,16H,12-15H2.
What are the key properties of [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone?
[4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone has a molecular weight of 376.41 g/mol, XLogP of 3.67, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(furan-2-carbonyl)piperazin-1-yl]-(2-phenoxyphenyl)methanone is sourced from PubChem (CID 2218605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).