(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol

C14H20N2O — CID 59144793

IUPAC(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESOc1cccc2c1C[C@H](N1CCNCC1)CC2
InChIInChI=1S/C14H20N2O/c17-14-3-1-2-11-4-5-12(10-13(11)14)16-8-6-15-7-9-16/h1-3,12,15,17H,4-10H2/t12-/m1/s1
InChIKeyGEXMVYUQTAYLMY-GFCCVEGCSA-N
MW232.33 g/mol
LogP1.15
Rot. Bonds1

About (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol

(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 59144793) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID59144793
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESOc1cccc2c1C[C@H](N1CCNCC1)CC2
InChIInChI=1S/C14H20N2O/c17-14-3-1-2-11-4-5-12(10-13(11)14)16-8-6-15-7-9-16/h1-3,12,15,17H,4-10H2/t12-/m1/s1
InChIKeyGEXMVYUQTAYLMY-GFCCVEGCSA-N
XLogP1.15
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol (CID 59144793) is (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol is Oc1cccc2c1C[C@H](N1CCNCC1)CC2.
What is the InChIKey of (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is GEXMVYUQTAYLMY-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H20N2O/c17-14-3-1-2-11-4-5-12(10-13(11)14)16-8-6-15-7-9-16/h1-3,12,15,17H,4-10H2/t12-/m1/s1.
What are the key properties of (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol?
(7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 232.33 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-7-piperazin-1-yl-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 59144793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).