1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine

C19H24N2O2 — CID 600350

IUPAC1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine
SMILESCOc1ccccc1OCCN1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H24N2O2/c1-22-18-9-5-6-10-19(18)23-16-15-20-11-13-21(14-12-20)17-7-3-2-4-8-17/h2-10H,11-16H2,1H3
InChIKeyKRMCDFSQQNVCJH-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.90
Rot. Bonds6

About 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine

1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine (PubChem CID 600350) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine.

Molecular Properties

Compound Name1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine
PubChem CID600350
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine
SMILESCOc1ccccc1OCCN1CCN(c2ccccc2)CC1
InChIInChI=1S/C19H24N2O2/c1-22-18-9-5-6-10-19(18)23-16-15-20-11-13-21(14-12-20)17-7-3-2-4-8-17/h2-10H,11-16H2,1H3
InChIKeyKRMCDFSQQNVCJH-UHFFFAOYSA-N
XLogP2.90
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine?
The IUPAC name of 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine (CID 600350) is 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine.
What is the SMILES notation for 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine?
The canonical SMILES for 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine is COc1ccccc1OCCN1CCN(c2ccccc2)CC1.
What is the InChIKey of 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine?
The InChIKey is KRMCDFSQQNVCJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-22-18-9-5-6-10-19(18)23-16-15-20-11-13-21(14-12-20)17-7-3-2-4-8-17/h2-10H,11-16H2,1H3.
What are the key properties of 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine?
1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine has a molecular weight of 312.41 g/mol, XLogP of 2.90, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyphenoxy)ethyl]-4-phenylpiperazine is sourced from PubChem (CID 600350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).