2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide

C19H26N4O — CID 51108379

IUPAC2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide
SMILESCCCN1CCC(NC(=O)C(c2ccccc2)n2cccn2)CC1
InChIInChI=1S/C19H26N4O/c1-2-12-22-14-9-17(10-15-22)21-19(24)18(23-13-6-11-20-23)16-7-4-3-5-8-16/h3-8,11,13,17-18H,2,9-10,12,14-15H2,1H3,(H,21,24)
InChIKeyUJRLPXLORSOXGS-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.46
Rot. Bonds6

About 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide

2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide (PubChem CID 51108379) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound Name2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide
PubChem CID51108379
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide
SMILESCCCN1CCC(NC(=O)C(c2ccccc2)n2cccn2)CC1
InChIInChI=1S/C19H26N4O/c1-2-12-22-14-9-17(10-15-22)21-19(24)18(23-13-6-11-20-23)16-7-4-3-5-8-16/h3-8,11,13,17-18H,2,9-10,12,14-15H2,1H3,(H,21,24)
InChIKeyUJRLPXLORSOXGS-UHFFFAOYSA-N
XLogP2.46
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-phenyl-2-pyrazol-1-ylacetyl)amino]cyclohexane-1-carboxylic acid
CID 119230000
(2S)-2-amino-2-phenyl-N-(1-propylpiperidin-4-yl)acetamide
CID 104897650
(2S)-N-[(2R,4aS,8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]-2-phenyl-2-pyrazol-1-ylacetamide
CID 97014680
N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenyl-2-pyrazol-1-ylacetamide
CID 51104109
(1R,2R,4R,5R)-5-[(2-phenyl-2-pyrazol-1-ylacetyl)amino]bicyclo[2.2.1]heptane-2-carboxylic acid
CID 166275767
1-(1-propylpiperidin-4-yl)-3-[(2-pyrazol-1-ylphenyl)methyl]urea
CID 154748194
N-(3,3-diphenylpropyl)-1-propylpiperidin-4-amine
CID 2846321
1-(2,2-diphenylethyl)-2-methyl-3-(1-propylpiperidin-4-yl)guanidine;hydroiodide
CID 111019164
propyl 2-phenyl-2-pyrazol-1-ylacetate
CID 75417530
(2S)-N-(3-oxo-3-piperidin-1-ylpropyl)-2-phenyl-2-pyrazol-1-ylacetamide
CID 95280062
N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 17249951
(2R)-N-[(2S)-2-hydroxy-2-phenylethyl]-2-phenyl-2-pyrazol-1-ylacetamide
CID 94822827

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide?
The IUPAC name of 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide (CID 51108379) is 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide is CCCN1CCC(NC(=O)C(c2ccccc2)n2cccn2)CC1.
What is the InChIKey of 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide?
The InChIKey is UJRLPXLORSOXGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-2-12-22-14-9-17(10-15-22)21-19(24)18(23-13-6-11-20-23)16-7-4-3-5-8-16/h3-8,11,13,17-18H,2,9-10,12,14-15H2,1H3,(H,21,24).
What are the key properties of 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide?
2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide has a molecular weight of 326.44 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(1-propylpiperidin-4-yl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 51108379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).