1-(2-phenyl-2-pyridin-4-ylethyl)piperazine

C17H21N3 — CID 70241433

IUPAC1-(2-phenyl-2-pyridin-4-ylethyl)piperazine
SMILESc1ccc(C(CN2CCNCC2)c2ccncc2)cc1
InChIInChI=1S/C17H21N3/c1-2-4-15(5-3-1)17(16-6-8-18-9-7-16)14-20-12-10-19-11-13-20/h1-9,17,19H,10-14H2
InChIKeyCURUOIBSXZPLSO-UHFFFAOYSA-N
MW267.38 g/mol
LogP2.12
Rot. Bonds4

About 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine

1-(2-phenyl-2-pyridin-4-ylethyl)piperazine (PubChem CID 70241433) has the molecular formula C17H21N3 and a molecular weight of 267.38 g/mol. Its IUPAC name is 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine.

Molecular Properties

Compound Name1-(2-phenyl-2-pyridin-4-ylethyl)piperazine
PubChem CID70241433
Molecular FormulaC17H21N3
Molecular Weight267.38 g/mol
Exact Mass267.17
IUPAC Name1-(2-phenyl-2-pyridin-4-ylethyl)piperazine
SMILESc1ccc(C(CN2CCNCC2)c2ccncc2)cc1
InChIInChI=1S/C17H21N3/c1-2-4-15(5-3-1)17(16-6-8-18-9-7-16)14-20-12-10-19-11-13-20/h1-9,17,19H,10-14H2
InChIKeyCURUOIBSXZPLSO-UHFFFAOYSA-N
XLogP2.12
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-phenyl-2-pyridin-4-ylethyl)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

1-[phenyl(pyridin-4-yl)methyl]piperazine
CID 5035634
3-piperazin-1-yl-2-pyridin-4-ylpropan-1-ol
CID 117246514
3-piperazin-1-yl-2-pyridin-4-ylpropan-1-amine
CID 117246513
2-methyl-3-piperazin-1-yl-1-pyridin-4-ylpropan-1-amine
CID 116946629
1-[(2R)-2-pyridin-3-ylpropyl]piperazine
CID 67593511
2-(1,4-diazepan-1-yl)-1-phenylethanamine
CID 63771215
1-(3-methyl-2-phenylpentyl)piperazine
CID 62488695
1-[2-phenyl-2-[4-(trifluoromethyl)phenoxy]ethyl]piperazine
CID 143117253
1-(2-piperazin-1-yl-1-pyridin-3-ylethyl)azepane
CID 82201767
1-(2-benzhydryloxyethyl)piperazine chloride
CID 53314194
N,N-diethyl-2-piperazin-1-yl-1-pyridin-3-ylethanamine
CID 82201783
1-[2-(3,5-dimethylpiperidin-1-yl)-2-phenylethyl]piperazine
CID 82201637

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine?
The IUPAC name of 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine (CID 70241433) is 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine.
What is the SMILES notation for 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine?
The canonical SMILES for 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine is c1ccc(C(CN2CCNCC2)c2ccncc2)cc1.
What is the InChIKey of 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine?
The InChIKey is CURUOIBSXZPLSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3/c1-2-4-15(5-3-1)17(16-6-8-18-9-7-16)14-20-12-10-19-11-13-20/h1-9,17,19H,10-14H2.
What are the key properties of 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine?
1-(2-phenyl-2-pyridin-4-ylethyl)piperazine has a molecular weight of 267.38 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenyl-2-pyridin-4-ylethyl)piperazine is sourced from PubChem (CID 70241433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).