2-(4-propylpiperazin-1-yl)phenol

C13H20N2O — CID 44570659

IUPAC2-(4-propylpiperazin-1-yl)phenol
SMILESCCCN1CCN(c2ccccc2O)CC1
InChIInChI=1S/C13H20N2O/c1-2-7-14-8-10-15(11-9-14)12-5-3-4-6-13(12)16/h3-6,16H,2,7-11H2,1H3
InChIKeyCERLVSBDHAPEMZ-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.92
Rot. Bonds3

About 2-(4-propylpiperazin-1-yl)phenol

2-(4-propylpiperazin-1-yl)phenol (PubChem CID 44570659) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(4-propylpiperazin-1-yl)phenol.

Molecular Properties

Compound Name2-(4-propylpiperazin-1-yl)phenol
PubChem CID44570659
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-(4-propylpiperazin-1-yl)phenol
SMILESCCCN1CCN(c2ccccc2O)CC1
InChIInChI=1S/C13H20N2O/c1-2-7-14-8-10-15(11-9-14)12-5-3-4-6-13(12)16/h3-6,16H,2,7-11H2,1H3
InChIKeyCERLVSBDHAPEMZ-UHFFFAOYSA-N
XLogP1.92
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-(4-Hydroxyphenyl)piperazin-1-yl)ethanone
CID 712441
p-(1-Piperazinyl)phenol
CID 92467
o-(1-Piperazinyl)phenol
CID 70530
2-(Dimethylamino)phenol
CID 459235
1-(2-Methoxyphenyl)-4-propylpiperazine
CID 410747
1-(3-Hydroxyphenyl)-4-propylpiperazine
CID 22397846
p-(4-Isopropyl-1-piperazinyl)phenol
CID 689098
o-(Methylamino)phenol
CID 69138
1-Butyl-4-(2-methoxy-phenyl)-piperazine
CID 10354670
1-Ethyl-4-(2-methoxyphenyl)piperazine
CID 10376185
1-(2-Methoxyphenyl)-4-pentylpiperazine
CID 10422832
2-[4-(4-Nitrophenyl)piperazin-1-yl]phenol
CID 5033608

Frequently Asked Questions

What is the IUPAC name of 2-(4-propylpiperazin-1-yl)phenol?
The IUPAC name of 2-(4-propylpiperazin-1-yl)phenol (CID 44570659) is 2-(4-propylpiperazin-1-yl)phenol.
What is the SMILES notation for 2-(4-propylpiperazin-1-yl)phenol?
The canonical SMILES for 2-(4-propylpiperazin-1-yl)phenol is CCCN1CCN(c2ccccc2O)CC1.
What is the InChIKey of 2-(4-propylpiperazin-1-yl)phenol?
The InChIKey is CERLVSBDHAPEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-7-14-8-10-15(11-9-14)12-5-3-4-6-13(12)16/h3-6,16H,2,7-11H2,1H3.
What are the key properties of 2-(4-propylpiperazin-1-yl)phenol?
2-(4-propylpiperazin-1-yl)phenol has a molecular weight of 220.32 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propylpiperazin-1-yl)phenol is sourced from PubChem (CID 44570659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).