1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol

C19H24N2O2 — CID 21292084

IUPAC1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol
SMILESCOc1ccccc1C(O)CN1CCNCC1c1ccccc1
InChIInChI=1S/C19H24N2O2/c1-23-19-10-6-5-9-16(19)18(22)14-21-12-11-20-13-17(21)15-7-3-2-4-8-15/h2-10,17-18,20,22H,11-14H2,1H3
InChIKeyVRWRLTQYOWSTHZ-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.38
Rot. Bonds5

About 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol

1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol (PubChem CID 21292084) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol
PubChem CID21292084
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol
SMILESCOc1ccccc1C(O)CN1CCNCC1c1ccccc1
InChIInChI=1S/C19H24N2O2/c1-23-19-10-6-5-9-16(19)18(22)14-21-12-11-20-13-17(21)15-7-3-2-4-8-15/h2-10,17-18,20,22H,11-14H2,1H3
InChIKeyVRWRLTQYOWSTHZ-UHFFFAOYSA-N
XLogP2.38
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol?
The IUPAC name of 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol (CID 21292084) is 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol.
What is the SMILES notation for 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol?
The canonical SMILES for 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol is COc1ccccc1C(O)CN1CCNCC1c1ccccc1.
What is the InChIKey of 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol?
The InChIKey is VRWRLTQYOWSTHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-23-19-10-6-5-9-16(19)18(22)14-21-12-11-20-13-17(21)15-7-3-2-4-8-15/h2-10,17-18,20,22H,11-14H2,1H3.
What are the key properties of 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol?
1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol has a molecular weight of 312.41 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-2-(2-phenylpiperazin-1-yl)ethanol is sourced from PubChem (CID 21292084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).