N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide

C23H25N3O2S — CID 92601911

IUPACN-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide
SMILESCc1cc(Oc2ccc(NC(=O)Cc3ccsc3)cc2)cc(C2CCNCC2)n1
InChIInChI=1S/C23H25N3O2S/c1-16-12-21(14-22(25-16)18-6-9-24-10-7-18)28-20-4-2-19(3-5-20)26-23(27)13-17-8-11-29-15-17/h2-5,8,11-12,14-15,18,24H,6-7,9-10,13H2,1H3,(H,26,27)
InChIKeyAZUOVDPKVSEDEF-UHFFFAOYSA-N
MW407.54 g/mol
LogP4.89
Rot. Bonds6

About N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide

N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide (PubChem CID 92601911) has the molecular formula C23H25N3O2S and a molecular weight of 407.54 g/mol. Its IUPAC name is N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide
PubChem CID92601911
Molecular FormulaC23H25N3O2S
Molecular Weight407.54 g/mol
Exact Mass407.17
IUPAC NameN-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide
SMILESCc1cc(Oc2ccc(NC(=O)Cc3ccsc3)cc2)cc(C2CCNCC2)n1
InChIInChI=1S/C23H25N3O2S/c1-16-12-21(14-22(25-16)18-6-9-24-10-7-18)28-20-4-2-19(3-5-20)26-23(27)13-17-8-11-29-15-17/h2-5,8,11-12,14-15,18,24H,6-7,9-10,13H2,1H3,(H,26,27)
InChIKeyAZUOVDPKVSEDEF-UHFFFAOYSA-N
XLogP4.89
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.54
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide 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-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide?
The IUPAC name of N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide (CID 92601911) is N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide?
The canonical SMILES for N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide is Cc1cc(Oc2ccc(NC(=O)Cc3ccsc3)cc2)cc(C2CCNCC2)n1.
What is the InChIKey of N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide?
The InChIKey is AZUOVDPKVSEDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2S/c1-16-12-21(14-22(25-16)18-6-9-24-10-7-18)28-20-4-2-19(3-5-20)26-23(27)13-17-8-11-29-15-17/h2-5,8,11-12,14-15,18,24H,6-7,9-10,13H2,1H3,(H,26,27).
What are the key properties of N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide?
N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide has a molecular weight of 407.54 g/mol, XLogP of 4.89, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methyl-6-piperidin-4-yl-4-pyridinyl)oxy]phenyl]-2-thiophen-3-ylacetamide is sourced from PubChem (CID 92601911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).