3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide

C15H19N3O2 — CID 115621117

IUPAC3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide
SMILESCCCc1cc(NC(=O)CCOc2ccccc2)n[nH]1
InChIInChI=1S/C15H19N3O2/c1-2-6-12-11-14(18-17-12)16-15(19)9-10-20-13-7-4-3-5-8-13/h3-5,7-8,11H,2,6,9-10H2,1H3,(H2,16,17,18,19)
InChIKeyAZGFAEPMPXGLCQ-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.77
Rot. Bonds7

About 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide

3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide (PubChem CID 115621117) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide
PubChem CID115621117
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide
SMILESCCCc1cc(NC(=O)CCOc2ccccc2)n[nH]1
InChIInChI=1S/C15H19N3O2/c1-2-6-12-11-14(18-17-12)16-15(19)9-10-20-13-7-4-3-5-8-13/h3-5,7-8,11H,2,6,9-10H2,1H3,(H2,16,17,18,19)
InChIKeyAZGFAEPMPXGLCQ-UHFFFAOYSA-N
XLogP2.77
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-oxo-3-[(5-propyl-1H-pyrazol-3-yl)amino]propanoic acid
CID 104621777
3-phenyl-N-(5-propyl-1H-pyrazol-3-yl)prop-2-ynamide
CID 115672265
N-(5-methyl-1H-pyrazol-3-yl)-2-phenoxyacetamide
CID 47148567
3-amino-3-phenyl-N-(5-propyl-1H-pyrazol-3-yl)propanamide
CID 104618213
2-(2-phenylethylsulfanyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 115621083
2-(2-chlorophenyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 115619750
3-[3-(4-fluorophenoxy)propanoylamino]-1H-pyrazole-5-carboxylic acid
CID 64529225
1,1-dimethyl-3-(5-propyl-1H-pyrazol-3-yl)urea
CID 115621073
3-methyl-N-(5-propyl-1H-pyrazol-3-yl)butanamide
CID 115619770
2-(4-methylphenyl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 112690378
N-(5-propyl-1H-pyrazol-3-yl)-2-pyridin-4-ylacetamide
CID 112680470
N-(5-ethyl-1H-pyrazol-3-yl)-3-phenylsulfanylpropanamide
CID 104619671

Frequently Asked Questions

What is the IUPAC name of 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide (CID 115621117) is 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide is CCCc1cc(NC(=O)CCOc2ccccc2)n[nH]1.
What is the InChIKey of 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide?
The InChIKey is AZGFAEPMPXGLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-6-12-11-14(18-17-12)16-15(19)9-10-20-13-7-4-3-5-8-13/h3-5,7-8,11H,2,6,9-10H2,1H3,(H2,16,17,18,19).
What are the key properties of 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide?
3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide has a molecular weight of 273.34 g/mol, XLogP of 2.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenoxy-N-(5-propyl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 115621117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).