N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide

C15H19N3O2 — CID 42686882

IUPACN-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide
SMILESCCC(=O)Nc1c(-c2cccc(OC)c2)n[nH]c1CC
InChIInChI=1S/C15H19N3O2/c1-4-12-15(16-13(19)5-2)14(18-17-12)10-7-6-8-11(9-10)20-3/h6-9H,4-5H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyPPIAEUJKNSSIJX-UHFFFAOYSA-N
MW273.34 g/mol
LogP3.00
Rot. Bonds5

About N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide

N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide (PubChem CID 42686882) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide.

Molecular Properties

Compound NameN-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide
PubChem CID42686882
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide
SMILESCCC(=O)Nc1c(-c2cccc(OC)c2)n[nH]c1CC
InChIInChI=1S/C15H19N3O2/c1-4-12-15(16-13(19)5-2)14(18-17-12)10-7-6-8-11(9-10)20-3/h6-9H,4-5H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyPPIAEUJKNSSIJX-UHFFFAOYSA-N
XLogP3.00
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-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 N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide?
The IUPAC name of N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide (CID 42686882) is N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide.
What is the SMILES notation for N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide?
The canonical SMILES for N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide is CCC(=O)Nc1c(-c2cccc(OC)c2)n[nH]c1CC.
What is the InChIKey of N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide?
The InChIKey is PPIAEUJKNSSIJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-4-12-15(16-13(19)5-2)14(18-17-12)10-7-6-8-11(9-10)20-3/h6-9H,4-5H2,1-3H3,(H,16,19)(H,17,18).
What are the key properties of N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide?
N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide has a molecular weight of 273.34 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-ethyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]propanamide is sourced from PubChem (CID 42686882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).