1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide

C21H25N3O4 — CID 24790724

IUPAC1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide
SMILESCOCCC(=O)N1CCC(C(=O)Nc2ccc(Oc3ccccc3)nc2)CC1
InChIInChI=1S/C21H25N3O4/c1-27-14-11-20(25)24-12-9-16(10-13-24)21(26)23-17-7-8-19(22-15-17)28-18-5-3-2-4-6-18/h2-8,15-16H,9-14H2,1H3,(H,23,26)
InChIKeyXEFDLHWXJLXUMS-UHFFFAOYSA-N
MW383.45 g/mol
LogP3.09
Rot. Bonds7

About 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide

1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide (PubChem CID 24790724) has the molecular formula C21H25N3O4 and a molecular weight of 383.45 g/mol. Its IUPAC name is 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide
PubChem CID24790724
Molecular FormulaC21H25N3O4
Molecular Weight383.45 g/mol
Exact Mass383.18
IUPAC Name1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide
SMILESCOCCC(=O)N1CCC(C(=O)Nc2ccc(Oc3ccccc3)nc2)CC1
InChIInChI=1S/C21H25N3O4/c1-27-14-11-20(25)24-12-9-16(10-13-24)21(26)23-17-7-8-19(22-15-17)28-18-5-3-2-4-6-18/h2-8,15-16H,9-14H2,1H3,(H,23,26)
InChIKeyXEFDLHWXJLXUMS-UHFFFAOYSA-N
XLogP3.09
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)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 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide (CID 24790724) is 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide is COCCC(=O)N1CCC(C(=O)Nc2ccc(Oc3ccccc3)nc2)CC1.
What is the InChIKey of 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
The InChIKey is XEFDLHWXJLXUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O4/c1-27-14-11-20(25)24-12-9-16(10-13-24)21(26)23-17-7-8-19(22-15-17)28-18-5-3-2-4-6-18/h2-8,15-16H,9-14H2,1H3,(H,23,26).
What are the key properties of 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide?
1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 3.09, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypropanoyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 24790724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).