5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol

C14H19NO2 — CID 83824135

IUPAC5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol
SMILESOC1CCc2cc(NC3CCOCC3)ccc21
InChIInChI=1S/C14H19NO2/c16-14-4-1-10-9-12(2-3-13(10)14)15-11-5-7-17-8-6-11/h2-3,9,11,14-16H,1,4-8H2
InChIKeyHGAALWIVPGUBGE-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.26
Rot. Bonds2

About 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol

5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol (PubChem CID 83824135) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol
PubChem CID83824135
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol
SMILESOC1CCc2cc(NC3CCOCC3)ccc21
InChIInChI=1S/C14H19NO2/c16-14-4-1-10-9-12(2-3-13(10)14)15-11-5-7-17-8-6-11/h2-3,9,11,14-16H,1,4-8H2
InChIKeyHGAALWIVPGUBGE-UHFFFAOYSA-N
XLogP2.26
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol (CID 83824135) is 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol is OC1CCc2cc(NC3CCOCC3)ccc21.
What is the InChIKey of 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is HGAALWIVPGUBGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c16-14-4-1-10-9-12(2-3-13(10)14)15-11-5-7-17-8-6-11/h2-3,9,11,14-16H,1,4-8H2.
What are the key properties of 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol?
5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 233.31 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxan-4-ylamino)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 83824135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).