ethane;1-(2-ethoxyphenyl)piperazine

C14H24N2O — CID 142040905

IUPACethane;1-(2-ethoxyphenyl)piperazine
SMILESCC.CCOc1ccccc1N1CCNCC1
InChIInChI=1S/C12H18N2O.C2H6/c1-2-15-12-6-4-3-5-11(12)14-9-7-13-8-10-14;1-2/h3-6,13H,2,7-10H2,1H3;1-2H3
InChIKeyBTFVGLREAZPXSH-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.52
Rot. Bonds3

About ethane;1-(2-ethoxyphenyl)piperazine

ethane;1-(2-ethoxyphenyl)piperazine (PubChem CID 142040905) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is ethane;1-(2-ethoxyphenyl)piperazine.

Molecular Properties

Compound Nameethane;1-(2-ethoxyphenyl)piperazine
PubChem CID142040905
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Nameethane;1-(2-ethoxyphenyl)piperazine
SMILESCC.CCOc1ccccc1N1CCNCC1
InChIInChI=1S/C12H18N2O.C2H6/c1-2-15-12-6-4-3-5-11(12)14-9-7-13-8-10-14;1-2/h3-6,13H,2,7-10H2,1H3;1-2H3
InChIKeyBTFVGLREAZPXSH-UHFFFAOYSA-N
XLogP2.52
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 63461603
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CID 65181009
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2-[(2-piperazin-1-ylphenoxy)methyl]pyrimidine
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1-[2-(3-methylbut-2-enoxy)phenyl]piperazine
CID 114284672
1-[2-(2-methylbutoxy)phenyl]-1,4-diazepane
CID 55037049
1-[2-(2,2,3,3,3-pentafluoropropoxy)phenyl]piperazine
CID 173335330
1-(2-ethoxyphenyl)-4-methyl-1,5-diazocane
CID 54973542
4-(2-piperazin-1-ylphenoxy)butanenitrile
CID 114284674
N-ethyl-N-[(2R)-1-(2-piperazin-1-ylphenoxy)propan-2-yl]methanesulfonamide
CID 18436788
1-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]phenyl]-1,4-diazepane
CID 115943307
1-[2-[(5-methyloxolan-2-yl)methoxy]phenyl]piperazine
CID 103137197

Frequently Asked Questions

What is the IUPAC name of ethane;1-(2-ethoxyphenyl)piperazine?
The IUPAC name of ethane;1-(2-ethoxyphenyl)piperazine (CID 142040905) is ethane;1-(2-ethoxyphenyl)piperazine.
What is the SMILES notation for ethane;1-(2-ethoxyphenyl)piperazine?
The canonical SMILES for ethane;1-(2-ethoxyphenyl)piperazine is CC.CCOc1ccccc1N1CCNCC1.
What is the InChIKey of ethane;1-(2-ethoxyphenyl)piperazine?
The InChIKey is BTFVGLREAZPXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O.C2H6/c1-2-15-12-6-4-3-5-11(12)14-9-7-13-8-10-14;1-2/h3-6,13H,2,7-10H2,1H3;1-2H3.
What are the key properties of ethane;1-(2-ethoxyphenyl)piperazine?
ethane;1-(2-ethoxyphenyl)piperazine has a molecular weight of 236.36 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(2-ethoxyphenyl)piperazine is sourced from PubChem (CID 142040905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).