4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol

C14H22N2O — CID 82187948

IUPAC4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol
SMILESCCN1CCN(CCc2ccc(O)cc2)CC1
InChIInChI=1S/C14H22N2O/c1-2-15-9-11-16(12-10-15)8-7-13-3-5-14(17)6-4-13/h3-6,17H,2,7-12H2,1H3
InChIKeyHANUHCORDCGPFU-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.57
Rot. Bonds4

About 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol

4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol (PubChem CID 82187948) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol.

Molecular Properties

Compound Name4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol
PubChem CID82187948
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol
SMILESCCN1CCN(CCc2ccc(O)cc2)CC1
InChIInChI=1S/C14H22N2O/c1-2-15-9-11-16(12-10-15)8-7-13-3-5-14(17)6-4-13/h3-6,17H,2,7-12H2,1H3
InChIKeyHANUHCORDCGPFU-UHFFFAOYSA-N
XLogP1.57
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol?
The IUPAC name of 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol (CID 82187948) is 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol.
What is the SMILES notation for 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol?
The canonical SMILES for 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol is CCN1CCN(CCc2ccc(O)cc2)CC1.
What is the InChIKey of 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol?
The InChIKey is HANUHCORDCGPFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-2-15-9-11-16(12-10-15)8-7-13-3-5-14(17)6-4-13/h3-6,17H,2,7-12H2,1H3.
What are the key properties of 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol?
4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol has a molecular weight of 234.34 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-ethylpiperazin-1-yl)ethyl]phenol is sourced from PubChem (CID 82187948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).