N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide

C14H17N3O2 — CID 54903792

IUPACN-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide
SMILESCC(C(=O)NCCc1ccc(O)cc1)n1cccn1
InChIInChI=1S/C14H17N3O2/c1-11(17-10-2-8-16-17)14(19)15-9-7-12-3-5-13(18)6-4-12/h2-6,8,10-11,18H,7,9H2,1H3,(H,15,19)
InChIKeyZOLZVGGDLVOLPO-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.51
Rot. Bonds5

About N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide

N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide (PubChem CID 54903792) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide
PubChem CID54903792
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide
SMILESCC(C(=O)NCCc1ccc(O)cc1)n1cccn1
InChIInChI=1S/C14H17N3O2/c1-11(17-10-2-8-16-17)14(19)15-9-7-12-3-5-13(18)6-4-12/h2-6,8,10-11,18H,7,9H2,1H3,(H,15,19)
InChIKeyZOLZVGGDLVOLPO-UHFFFAOYSA-N
XLogP1.51
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-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 N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide (CID 54903792) is N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide is CC(C(=O)NCCc1ccc(O)cc1)n1cccn1.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide?
The InChIKey is ZOLZVGGDLVOLPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-11(17-10-2-8-16-17)14(19)15-9-7-12-3-5-13(18)6-4-12/h2-6,8,10-11,18H,7,9H2,1H3,(H,15,19).
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide?
N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide has a molecular weight of 259.31 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxyphenyl)ethyl]-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 54903792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).