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

C13H17NO — CID 105455650

IUPAC2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol
SMILESOc1ccc2c(c1)CC(NC1CCC1)C2
InChIInChI=1S/C13H17NO/c15-13-5-4-9-6-12(7-10(9)8-13)14-11-2-1-3-11/h4-5,8,11-12,14-15H,1-3,6-7H2
InChIKeyYSKFJLAHEWJBIV-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.00
Rot. Bonds2

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

2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol (PubChem CID 105455650) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol
PubChem CID105455650
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC Name2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol
SMILESOc1ccc2c(c1)CC(NC1CCC1)C2
InChIInChI=1S/C13H17NO/c15-13-5-4-9-6-12(7-10(9)8-13)14-11-2-1-3-11/h4-5,8,11-12,14-15H,1-3,6-7H2
InChIKeyYSKFJLAHEWJBIV-UHFFFAOYSA-N
XLogP2.00
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-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 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol (CID 105455650) is 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol is Oc1ccc2c(c1)CC(NC1CCC1)C2.
What is the InChIKey of 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol?
The InChIKey is YSKFJLAHEWJBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c15-13-5-4-9-6-12(7-10(9)8-13)14-11-2-1-3-11/h4-5,8,11-12,14-15H,1-3,6-7H2.
What are the key properties of 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol?
2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol has a molecular weight of 203.29 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutylamino)-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 105455650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).