(2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone

C17H20N2O2 — CID 2366104

IUPAC(2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone
SMILESCc1cc(C(=O)N2CCN(c3ccccc3)CC2)c(C)o1
InChIInChI=1S/C17H20N2O2/c1-13-12-16(14(2)21-13)17(20)19-10-8-18(9-11-19)15-6-4-3-5-7-15/h3-7,12H,8-11H2,1-2H3
InChIKeyUUWUVPBYBLFPEN-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.86
Rot. Bonds2

About (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone

(2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone (PubChem CID 2366104) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone
PubChem CID2366104
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name(2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone
SMILESCc1cc(C(=O)N2CCN(c3ccccc3)CC2)c(C)o1
InChIInChI=1S/C17H20N2O2/c1-13-12-16(14(2)21-13)17(20)19-10-8-18(9-11-19)15-6-4-3-5-7-15/h3-7,12H,8-11H2,1-2H3
InChIKeyUUWUVPBYBLFPEN-UHFFFAOYSA-N
XLogP2.86
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone 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

Methfuroxam
CID 34313
Fenfuram
CID 90590
2,5-Dimethyl-3-furancarboxanilide
CID 34281
3-Furanylfentanyl
CID 13653684
2,3-Dihydroindol-1-yl-(2-methylfuran-3-yl)methanone
CID 705594
1-[1-(2-Methylfuran-3-carbonyl)piperidin-4-yl]-3-[4-(trifluoromethyl)phenyl]urea
CID 118409089
(E)-3-(furan-2-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one
CID 963834
(4-Benzylpiperidin-1-yl)-(2,5-dimethylfuran-3-yl)methanone
CID 1245621
N-[4-(benzyloxy)phenyl]-2,5-dimethyl-3-furamide
CID 1247120
N-[2-(3,4-difluoroanilino)-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide
CID 2558565
2,5-dimethyl-N-(2-morpholinophenyl)-3-furamide
CID 2811740
[5-(Tert-butyl)-2-methyl-3-furyl][4-(2-methoxyphenyl)piperazino]methanone
CID 2812051

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone?
The IUPAC name of (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone (CID 2366104) is (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone.
What is the SMILES notation for (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone?
The canonical SMILES for (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone is Cc1cc(C(=O)N2CCN(c3ccccc3)CC2)c(C)o1.
What is the InChIKey of (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone?
The InChIKey is UUWUVPBYBLFPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-13-12-16(14(2)21-13)17(20)19-10-8-18(9-11-19)15-6-4-3-5-7-15/h3-7,12H,8-11H2,1-2H3.
What are the key properties of (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone?
(2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone has a molecular weight of 284.36 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylfuran-3-yl)-(4-phenylpiperazin-1-yl)methanone is sourced from PubChem (CID 2366104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).