8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol

C11H15NO — CID 83827745

IUPAC8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESNCC1CCCc2cccc(O)c21
InChIInChI=1S/C11H15NO/c12-7-9-5-1-3-8-4-2-6-10(13)11(8)9/h2,4,6,9,13H,1,3,5,7,12H2
InChIKeyYRAZWRVQNBHMKJ-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.77
Rot. Bonds1

About 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol

8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 83827745) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID83827745
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESNCC1CCCc2cccc(O)c21
InChIInChI=1S/C11H15NO/c12-7-9-5-1-3-8-4-2-6-10(13)11(8)9/h2,4,6,9,13H,1,3,5,7,12H2
InChIKeyYRAZWRVQNBHMKJ-UHFFFAOYSA-N
XLogP1.77
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol (CID 83827745) is 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol is NCC1CCCc2cccc(O)c21.
What is the InChIKey of 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is YRAZWRVQNBHMKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c12-7-9-5-1-3-8-4-2-6-10(13)11(8)9/h2,4,6,9,13H,1,3,5,7,12H2.
What are the key properties of 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol?
8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 177.25 g/mol, XLogP of 1.77, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 83827745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).