1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine

C19H20N4 — CID 31074314

IUPAC1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine
SMILESc1cc(-c2cccc(N3CCNCC3)c2)cc(-c2ccn[nH]2)c1
InChIInChI=1S/C19H20N4/c1-3-15(13-17(5-1)19-7-8-21-22-19)16-4-2-6-18(14-16)23-11-9-20-10-12-23/h1-8,13-14,20H,9-12H2,(H,21,22)
InChIKeyDALVLUCFELTWRM-UHFFFAOYSA-N
MW304.40 g/mol
LogP3.15
Rot. Bonds3

About 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine

1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine (PubChem CID 31074314) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine.

Molecular Properties

Compound Name1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine
PubChem CID31074314
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC Name1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine
SMILESc1cc(-c2cccc(N3CCNCC3)c2)cc(-c2ccn[nH]2)c1
InChIInChI=1S/C19H20N4/c1-3-15(13-17(5-1)19-7-8-21-22-19)16-4-2-6-18(14-16)23-11-9-20-10-12-23/h1-8,13-14,20H,9-12H2,(H,21,22)
InChIKeyDALVLUCFELTWRM-UHFFFAOYSA-N
XLogP3.15
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine 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

5-(3-pyrrolidin-1-ylphenyl)-1H-pyrazole
CID 141365895
1-(3-pyridin-3-ylphenyl)piperazine
CID 150431219
1-[3-(3-fluorophenyl)phenyl]piperazine
CID 82088997
1-[4-(1H-pyrazol-5-yl)-2-pyridinyl]piperazine
CID 105486911
3-methyl-5-(3-piperazin-1-ylphenyl)pyridin-2-amine
CID 72877578
1-propan-2-yl-4-[1-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-yl]-1,4-diazepane
CID 31105427
1-[3-(4-fluoro-3-methylphenyl)phenyl]piperazine;hydrochloride
CID 154914779
(3R)-1-[1-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-yl]piperidine-3-carboxamide
CID 31073994
4-[(3R)-3-(3,5-dimethylpyrazol-1-yl)pyrrolidin-1-yl]-1-[3-(1H-pyrazol-5-yl)phenyl]piperidine
CID 31016874
(3-piperazin-1-ylphenyl)methanamine
CID 83775094
1-(3-ethylphenyl)piperazine;hydrochloride
CID 19911472
6-fluoro-8-(3-piperazin-1-ylphenyl)quinoline;hydrochloride
CID 154914716

Frequently Asked Questions

What is the IUPAC name of 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine?
The IUPAC name of 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine (CID 31074314) is 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine.
What is the SMILES notation for 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine?
The canonical SMILES for 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine is c1cc(-c2cccc(N3CCNCC3)c2)cc(-c2ccn[nH]2)c1.
What is the InChIKey of 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine?
The InChIKey is DALVLUCFELTWRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c1-3-15(13-17(5-1)19-7-8-21-22-19)16-4-2-6-18(14-16)23-11-9-20-10-12-23/h1-8,13-14,20H,9-12H2,(H,21,22).
What are the key properties of 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine?
1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine has a molecular weight of 304.40 g/mol, XLogP of 3.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]piperazine is sourced from PubChem (CID 31074314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).