N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide

C21H25N3O4 — CID 72882868

IUPACN-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc(-c2ccco2)c1)C1CCN(C(=O)C2CNCCO2)CC1
InChIInChI=1S/C21H25N3O4/c25-20(23-17-4-1-3-16(13-17)18-5-2-11-27-18)15-6-9-24(10-7-15)21(26)19-14-22-8-12-28-19/h1-5,11,13,15,19,22H,6-10,12,14H2,(H,23,25)
InChIKeyWNCYNWQLPQRWQZ-UHFFFAOYSA-N
MW383.45 g/mol
LogP2.11
Rot. Bonds4

About N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide

N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide (PubChem CID 72882868) has the molecular formula C21H25N3O4 and a molecular weight of 383.45 g/mol. Its IUPAC name is N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide
PubChem CID72882868
Molecular FormulaC21H25N3O4
Molecular Weight383.45 g/mol
Exact Mass383.18
IUPAC NameN-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc(-c2ccco2)c1)C1CCN(C(=O)C2CNCCO2)CC1
InChIInChI=1S/C21H25N3O4/c25-20(23-17-4-1-3-16(13-17)18-5-2-11-27-18)15-6-9-24(10-7-15)21(26)19-14-22-8-12-28-19/h1-5,11,13,15,19,22H,6-10,12,14H2,(H,23,25)
InChIKeyWNCYNWQLPQRWQZ-UHFFFAOYSA-N
XLogP2.11
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide 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-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide (CID 72882868) is N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide is O=C(Nc1cccc(-c2ccco2)c1)C1CCN(C(=O)C2CNCCO2)CC1.
What is the InChIKey of N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is WNCYNWQLPQRWQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O4/c25-20(23-17-4-1-3-16(13-17)18-5-2-11-27-18)15-6-9-24(10-7-15)21(26)19-14-22-8-12-28-19/h1-5,11,13,15,19,22H,6-10,12,14H2,(H,23,25).
What are the key properties of N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide?
N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)phenyl]-1-(morpholine-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 72882868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).