spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol

C11H13NO — CID 105436202

IUPACspiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol
SMILESOc1ccc2c(c1)C1(CCN2)CC1
InChIInChI=1S/C11H13NO/c13-8-1-2-10-9(7-8)11(3-4-11)5-6-12-10/h1-2,7,12-13H,3-6H2
InChIKeyDFKVJZXUVKHOMJ-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.24
Rot. Bonds

About spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol

spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol (PubChem CID 105436202) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol.

Molecular Properties

Compound Namespiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol
PubChem CID105436202
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Namespiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol
SMILESOc1ccc2c(c1)C1(CCN2)CC1
InChIInChI=1S/C11H13NO/c13-8-1-2-10-9(7-8)11(3-4-11)5-6-12-10/h1-2,7,12-13H,3-6H2
InChIKeyDFKVJZXUVKHOMJ-UHFFFAOYSA-N
XLogP2.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol?
The IUPAC name of spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol (CID 105436202) is spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol.
What is the SMILES notation for spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol?
The canonical SMILES for spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol is Oc1ccc2c(c1)C1(CCN2)CC1.
What is the InChIKey of spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol?
The InChIKey is DFKVJZXUVKHOMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c13-8-1-2-10-9(7-8)11(3-4-11)5-6-12-10/h1-2,7,12-13H,3-6H2.
What are the key properties of spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol?
spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol has a molecular weight of 175.23 g/mol, XLogP of 2.24, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2,3-dihydro-1H-quinoline-4,1'-cyclopropane]-6-ol is sourced from PubChem (CID 105436202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).