(4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone

C19H23N3O3 — CID 136558450

IUPAC(4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone
SMILESCCOc1ccc(C(=O)N2CCN(c3cncc(OC)c3)CC2)cc1
InChIInChI=1S/C19H23N3O3/c1-3-25-17-6-4-15(5-7-17)19(23)22-10-8-21(9-11-22)16-12-18(24-2)14-20-13-16/h4-7,12-14H,3,8-11H2,1-2H3
InChIKeyZTQRBHQFHDXYLM-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.45
Rot. Bonds5

About (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone

(4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone (PubChem CID 136558450) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone
PubChem CID136558450
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name(4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone
SMILESCCOc1ccc(C(=O)N2CCN(c3cncc(OC)c3)CC2)cc1
InChIInChI=1S/C19H23N3O3/c1-3-25-17-6-4-15(5-7-17)19(23)22-10-8-21(9-11-22)16-12-18(24-2)14-20-13-16/h4-7,12-14H,3,8-11H2,1-2H3
InChIKeyZTQRBHQFHDXYLM-UHFFFAOYSA-N
XLogP2.45
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

aziridin-1-yl-(4-ethoxyphenyl)methanone
CID 121216936
(3,4-dimethylphenyl)-[4-(4-ethoxyphenyl)piperazin-1-yl]methanone
CID 113077431
[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 126826218
[4-(4-methoxyphenyl)piperazin-1-yl]-pyridin-4-ylmethanone
CID 1244092
(4-ethoxyphenyl)-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]methanone
CID 71571371
[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]-(4-ethoxyphenyl)methanone
CID 108543772
[4-(3-ethoxyphenyl)piperazin-1-yl]-(4-methylphenyl)methanone
CID 129043282
[4-(3,4-dichlorophenyl)piperazin-1-yl]-[4-(4-methoxyphenoxy)phenyl]methanone
CID 25093752
[4-(4-methoxyphenyl)piperazin-1-yl]-[4-(2-methylprop-2-enoxy)phenyl]methanone
CID 40696784
1-ethyl-4-(5-methoxy-3-pyridinyl)piperazine
CID 22053538
1,3-benzodioxol-5-yl-[4-(4-ethoxyphenyl)piperazin-1-yl]methanone
CID 113077448
[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]-(3-methoxyquinolin-4-yl)methanone
CID 136558459

Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone?
The IUPAC name of (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone (CID 136558450) is (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone.
What is the SMILES notation for (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone?
The canonical SMILES for (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone is CCOc1ccc(C(=O)N2CCN(c3cncc(OC)c3)CC2)cc1.
What is the InChIKey of (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone?
The InChIKey is ZTQRBHQFHDXYLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-3-25-17-6-4-15(5-7-17)19(23)22-10-8-21(9-11-22)16-12-18(24-2)14-20-13-16/h4-7,12-14H,3,8-11H2,1-2H3.
What are the key properties of (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone?
(4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone has a molecular weight of 341.41 g/mol, XLogP of 2.45, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl)-[4-(5-methoxy-3-pyridinyl)piperazin-1-yl]methanone is sourced from PubChem (CID 136558450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).