4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide

C20H22N4O3 — CID 30884899

IUPAC4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
SMILESCCOc1ccccc1OCCCC(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C20H22N4O3/c1-2-26-17-9-3-4-10-18(17)27-15-6-11-19(25)23-16-8-5-12-21-20(16)24-14-7-13-22-24/h3-5,7-10,12-14H,2,6,11,15H2,1H3,(H,23,25)
InChIKeyKBEZIRMHZULZNF-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.46
Rot. Bonds9

About 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide

4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide (PubChem CID 30884899) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide.

Molecular Properties

Compound Name4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
PubChem CID30884899
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
SMILESCCOc1ccccc1OCCCC(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C20H22N4O3/c1-2-26-17-9-3-4-10-18(17)27-15-6-11-19(25)23-16-8-5-12-21-20(16)24-14-7-13-22-24/h3-5,7-10,12-14H,2,6,11,15H2,1H3,(H,23,25)
InChIKeyKBEZIRMHZULZNF-UHFFFAOYSA-N
XLogP3.46
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide 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

4-(2-methylphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
CID 30887020
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064
5-(2,5-dimethylphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 60584957
5-bromo-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 107909063
7-amino-N-(2-pyrazol-1-yl-3-pyridinyl)heptanamide
CID 43714218
(E)-3-(3-ethoxy-4-propoxyphenyl)-N-(2-pyrazol-1-yl-3-pyridinyl)prop-2-enamide
CID 55611611
4-(2-ethoxyphenoxy)-N-(1-methylpyrazol-3-yl)butanamide
CID 7638259
4-(2-ethoxyphenoxy)-N-(2-methylsulfanylphenyl)butanamide
CID 7928453
2-phenylsulfanyl-N-(2-pyrazol-1-yl-3-pyridinyl)acetamide
CID 38749928
5-amino-4-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 82011031
4-(2-aminophenoxy)-N-(2-ethoxyphenyl)butanamide
CID 84553851
N-(2,3-dichlorophenyl)-4-(2-ethoxyphenoxy)butanamide
CID 26364358

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide?
The IUPAC name of 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide (CID 30884899) is 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide.
What is the SMILES notation for 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide?
The canonical SMILES for 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide is CCOc1ccccc1OCCCC(=O)Nc1cccnc1-n1cccn1.
What is the InChIKey of 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide?
The InChIKey is KBEZIRMHZULZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-2-26-17-9-3-4-10-18(17)27-15-6-11-19(25)23-16-8-5-12-21-20(16)24-14-7-13-22-24/h3-5,7-10,12-14H,2,6,11,15H2,1H3,(H,23,25).
What are the key properties of 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide?
4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide has a molecular weight of 366.42 g/mol, XLogP of 3.46, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide is sourced from PubChem (CID 30884899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).