N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide

C19H21N3O4 — CID 2987266

IUPACN-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)N2CCN(C(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C19H21N3O4/c1-2-17(23)20-15-7-5-14(6-8-15)18(24)21-9-11-22(12-10-21)19(25)16-4-3-13-26-16/h3-8,13H,2,9-12H2,1H3,(H,20,23)
InChIKeyHIUXVEDHLDBPNU-UHFFFAOYSA-N
MW355.39 g/mol
LogP2.23
Rot. Bonds4

About N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide

N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide (PubChem CID 2987266) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide.

Molecular Properties

Compound NameN-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide
PubChem CID2987266
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC NameN-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C(=O)N2CCN(C(=O)c3ccco3)CC2)cc1
InChIInChI=1S/C19H21N3O4/c1-2-17(23)20-15-7-5-14(6-8-15)18(24)21-9-11-22(12-10-21)19(25)16-4-3-13-26-16/h3-8,13H,2,9-12H2,1H3,(H,20,23)
InChIKeyHIUXVEDHLDBPNU-UHFFFAOYSA-N
XLogP2.23
TPSA82.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide 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 N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide?
The IUPAC name of N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide (CID 2987266) is N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide.
What is the SMILES notation for N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide?
The canonical SMILES for N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide is CCC(=O)Nc1ccc(C(=O)N2CCN(C(=O)c3ccco3)CC2)cc1.
What is the InChIKey of N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide?
The InChIKey is HIUXVEDHLDBPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-2-17(23)20-15-7-5-14(6-8-15)18(24)21-9-11-22(12-10-21)19(25)16-4-3-13-26-16/h3-8,13H,2,9-12H2,1H3,(H,20,23).
What are the key properties of N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide?
N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide has a molecular weight of 355.39 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]phenyl]propanamide is sourced from PubChem (CID 2987266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).