2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide

C23H32N4O2 — CID 142792466

IUPAC2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide
SMILESCCOc1ccc(C(Cc2ccncc2)(NCCC2CCNCC2)C(N)=O)cc1
InChIInChI=1S/C23H32N4O2/c1-2-29-21-5-3-20(4-6-21)23(22(24)28,17-19-9-14-26-15-10-19)27-16-11-18-7-12-25-13-8-18/h3-6,9-10,14-15,18,25,27H,2,7-8,11-13,16-17H2,1H3,(H2,24,28)
InChIKeyAVSMFZXLVMEFSF-UHFFFAOYSA-N
MW396.54 g/mol
LogP2.38
Rot. Bonds10

About 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide

2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide (PubChem CID 142792466) has the molecular formula C23H32N4O2 and a molecular weight of 396.54 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide
PubChem CID142792466
Molecular FormulaC23H32N4O2
Molecular Weight396.54 g/mol
Exact Mass396.25
IUPAC Name2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide
SMILESCCOc1ccc(C(Cc2ccncc2)(NCCC2CCNCC2)C(N)=O)cc1
InChIInChI=1S/C23H32N4O2/c1-2-29-21-5-3-20(4-6-21)23(22(24)28,17-19-9-14-26-15-10-19)27-16-11-18-7-12-25-13-8-18/h3-6,9-10,14-15,18,25,27H,2,7-8,11-13,16-17H2,1H3,(H2,24,28)
InChIKeyAVSMFZXLVMEFSF-UHFFFAOYSA-N
XLogP2.38
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.54
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide 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 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide?
The IUPAC name of 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide (CID 142792466) is 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide.
What is the SMILES notation for 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide?
The canonical SMILES for 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide is CCOc1ccc(C(Cc2ccncc2)(NCCC2CCNCC2)C(N)=O)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide?
The InChIKey is AVSMFZXLVMEFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O2/c1-2-29-21-5-3-20(4-6-21)23(22(24)28,17-19-9-14-26-15-10-19)27-16-11-18-7-12-25-13-8-18/h3-6,9-10,14-15,18,25,27H,2,7-8,11-13,16-17H2,1H3,(H2,24,28).
What are the key properties of 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide?
2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide has a molecular weight of 396.54 g/mol, XLogP of 2.38, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-2-(2-piperidin-4-ylethylamino)-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 142792466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).