5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol

C11H15NO — CID 83816705

IUPAC5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol
SMILESCN(C)c1ccc2c(c1)CCC2O
InChIInChI=1S/C11H15NO/c1-12(2)9-4-5-10-8(7-9)3-6-11(10)13/h4-5,7,11,13H,3,6H2,1-2H3
InChIKeyVZIUATBPXDYCIQ-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.73
Rot. Bonds1

About 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol

5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol (PubChem CID 83816705) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol
PubChem CID83816705
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol
SMILESCN(C)c1ccc2c(c1)CCC2O
InChIInChI=1S/C11H15NO/c1-12(2)9-4-5-10-8(7-9)3-6-11(10)13/h4-5,7,11,13H,3,6H2,1-2H3
InChIKeyVZIUATBPXDYCIQ-UHFFFAOYSA-N
XLogP1.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol (CID 83816705) is 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol is CN(C)c1ccc2c(c1)CCC2O.
What is the InChIKey of 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is VZIUATBPXDYCIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-12(2)9-4-5-10-8(7-9)3-6-11(10)13/h4-5,7,11,13H,3,6H2,1-2H3.
What are the key properties of 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol?
5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 177.25 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 83816705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).