7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol

C11H15NO — CID 89110450

IUPAC7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCNc1ccc2c(c1)C(O)CCC2
InChIInChI=1S/C11H15NO/c1-12-9-6-5-8-3-2-4-11(13)10(8)7-9/h5-7,11-13H,2-4H2,1H3
InChIKeyKYIHILPKVNYISJ-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.10
Rot. Bonds1

About 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol

7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 89110450) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID89110450
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCNc1ccc2c(c1)C(O)CCC2
InChIInChI=1S/C11H15NO/c1-12-9-6-5-8-3-2-4-11(13)10(8)7-9/h5-7,11-13H,2-4H2,1H3
InChIKeyKYIHILPKVNYISJ-UHFFFAOYSA-N
XLogP2.10
TPSA32.26 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 ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol (CID 89110450) is 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol is CNc1ccc2c(c1)C(O)CCC2.
What is the InChIKey of 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is KYIHILPKVNYISJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-12-9-6-5-8-3-2-4-11(13)10(8)7-9/h5-7,11-13H,2-4H2,1H3.
What are the key properties of 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol?
7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 177.25 g/mol, XLogP of 2.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 89110450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).