1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine

C17H24N4 — CID 71845676

IUPAC1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine
SMILESCCCN1CCN(Cn2cc(-c3ccccc3)cn2)CC1
InChIInChI=1S/C17H24N4/c1-2-8-19-9-11-20(12-10-19)15-21-14-17(13-18-21)16-6-4-3-5-7-16/h3-7,13-14H,2,8-12,15H2,1H3
InChIKeyJGDBAUXKDODYDV-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.54
Rot. Bonds5

About 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine

1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine (PubChem CID 71845676) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine.

Molecular Properties

Compound Name1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine
PubChem CID71845676
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine
SMILESCCCN1CCN(Cn2cc(-c3ccccc3)cn2)CC1
InChIInChI=1S/C17H24N4/c1-2-8-19-9-11-20(12-10-19)15-21-14-17(13-18-21)16-6-4-3-5-7-16/h3-7,13-14H,2,8-12,15H2,1H3
InChIKeyJGDBAUXKDODYDV-UHFFFAOYSA-N
XLogP2.54
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Fezolamine
CID 54567
1-Benzyl-4-(3-methyl-4-phenyl-pyrazol-1-yl)-piperidine
CID 21219157
1-[4-[(4-Phenylphenyl)methyl]piperazine-1-carbonyl]pyrazole-4-carbonitrile
CID 118526559
(4-Benzylpiperazin-1-yl)-pyrazol-1-ylmethanone
CID 118526402
(4-Benzylpiperazin-1-yl)-(4-methylpyrazol-1-yl)methanone
CID 118526594
1-(4-Benzylpiperazine-1-carbonyl)pyrazole-4-carbonitrile
CID 118526834
(4-Methylpyrazol-1-yl)-[4-[(4-phenylphenyl)methyl]piperazin-1-yl]methanone
CID 118526861
[4-[(4-Phenylphenyl)methyl]piperazin-1-yl]-pyrazol-1-ylmethanone
CID 118531126
1-Methyl-4-phenyl-1H-pyrazole
CID 13692442
3-[2-(2,4-difluorophenyl)ethyl]-1-[(1-methyl-1H-pyrazol-4-yl)methyl]piperidine
CID 45227951
1,2-dimethyl-4-[2-(1H-pyrazol-1-ylmethyl)benzyl]piperazine
CID 50962406
4-(1-tert-butyl-1H-pyrazol-4-yl)-1-(2-phenylethyl)-1,2,3,6-tetrahydropyridine
CID 50981214

Frequently Asked Questions

What is the IUPAC name of 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine?
The IUPAC name of 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine (CID 71845676) is 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine.
What is the SMILES notation for 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine?
The canonical SMILES for 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine is CCCN1CCN(Cn2cc(-c3ccccc3)cn2)CC1.
What is the InChIKey of 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine?
The InChIKey is JGDBAUXKDODYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-2-8-19-9-11-20(12-10-19)15-21-14-17(13-18-21)16-6-4-3-5-7-16/h3-7,13-14H,2,8-12,15H2,1H3.
What are the key properties of 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine?
1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine has a molecular weight of 284.41 g/mol, XLogP of 2.54, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-phenylpyrazol-1-yl)methyl]-4-propylpiperazine is sourced from PubChem (CID 71845676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).