3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide

C13H15N3O3 — CID 61393499

IUPAC3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide
SMILESCOc1ccc(OCCC(=O)Nc2ccn[nH]2)cc1
InChIInChI=1S/C13H15N3O3/c1-18-10-2-4-11(5-3-10)19-9-7-13(17)15-12-6-8-14-16-12/h2-6,8H,7,9H2,1H3,(H2,14,15,16,17)
InChIKeyAEVWLXBRJDBALF-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.83
Rot. Bonds6

About 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide

3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide (PubChem CID 61393499) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide.

Molecular Properties

Compound Name3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide
PubChem CID61393499
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide
SMILESCOc1ccc(OCCC(=O)Nc2ccn[nH]2)cc1
InChIInChI=1S/C13H15N3O3/c1-18-10-2-4-11(5-3-10)19-9-7-13(17)15-12-6-8-14-16-12/h2-6,8H,7,9H2,1H3,(H2,14,15,16,17)
InChIKeyAEVWLXBRJDBALF-UHFFFAOYSA-N
XLogP1.83
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide 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 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide?
The IUPAC name of 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide (CID 61393499) is 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide.
What is the SMILES notation for 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide?
The canonical SMILES for 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide is COc1ccc(OCCC(=O)Nc2ccn[nH]2)cc1.
What is the InChIKey of 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide?
The InChIKey is AEVWLXBRJDBALF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-18-10-2-4-11(5-3-10)19-9-7-13(17)15-12-6-8-14-16-12/h2-6,8H,7,9H2,1H3,(H2,14,15,16,17).
What are the key properties of 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide?
3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide has a molecular weight of 261.28 g/mol, XLogP of 1.83, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide is sourced from PubChem (CID 61393499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).