1-phenylpiperazine

C10H14N2 — CID 7096

IUPAC1-phenylpiperazine
SMILESc1ccc(N2CCNCC2)cc1
InChIInChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2
InChIKeyYZTJYBJCZXZGCT-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.10
Rot. Bonds1

About 1-phenylpiperazine

1-phenylpiperazine (PubChem CID 7096) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 1-phenylpiperazine.

Molecular Properties

Compound Name1-phenylpiperazine
PubChem CID7096
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name1-phenylpiperazine
SMILESc1ccc(N2CCNCC2)cc1
InChIInChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2
InChIKeyYZTJYBJCZXZGCT-UHFFFAOYSA-N
XLogP1.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Diphenylamine
CID 11487
N-isopropyl-N'-phenyl-p-phenylenediamine
CID 7573
N-Methylaniline
CID 7515
N-Ethylaniline
CID 7670
1-(3-Chlorophenyl)piperazine
CID 1355
N,N-dimethyl-p-phenylenediamine
CID 7472
1-(3-(Trifluoromethyl)phenyl)piperazine
CID 4296
N,N-Diethyl-p-phenylenediamine
CID 7120
N,N-Diethylaniline
CID 7061
N-Isopropylaniline
CID 13032
N,N'-Di-sec-butyl-p-phenylenediamine
CID 7589
1,1-Dimethyl-4-phenylpiperazinium iodide
CID 5911

Frequently Asked Questions

What is the IUPAC name of 1-phenylpiperazine?
The IUPAC name of 1-phenylpiperazine (CID 7096) is 1-phenylpiperazine.
What is the SMILES notation for 1-phenylpiperazine?
The canonical SMILES for 1-phenylpiperazine is c1ccc(N2CCNCC2)cc1.
What is the InChIKey of 1-phenylpiperazine?
The InChIKey is YZTJYBJCZXZGCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2.
What are the key properties of 1-phenylpiperazine?
1-phenylpiperazine has a molecular weight of 162.24 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylpiperazine is sourced from PubChem (CID 7096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).