spiro[pyrrolidine-3,9'-xanthene]

C16H15NO — CID 10444168

IUPACspiro[pyrrolidine-3,9'-xanthene]
SMILESc1ccc2c(c1)Oc1ccccc1C21CCNC1
InChIInChI=1S/C16H15NO/c1-3-7-14-12(5-1)16(9-10-17-11-16)13-6-2-4-8-15(13)18-14/h1-8,17H,9-11H2
InChIKeyYMGYTLOMZJSEAZ-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.07
Rot. Bonds

About spiro[pyrrolidine-3,9'-xanthene]

spiro[pyrrolidine-3,9'-xanthene] (PubChem CID 10444168) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is spiro[pyrrolidine-3,9'-xanthene].

Molecular Properties

Compound Namespiro[pyrrolidine-3,9'-xanthene]
PubChem CID10444168
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Namespiro[pyrrolidine-3,9'-xanthene]
SMILESc1ccc2c(c1)Oc1ccccc1C21CCNC1
InChIInChI=1S/C16H15NO/c1-3-7-14-12(5-1)16(9-10-17-11-16)13-6-2-4-8-15(13)18-14/h1-8,17H,9-11H2
InChIKeyYMGYTLOMZJSEAZ-UHFFFAOYSA-N
XLogP3.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[pyrrolidine-3,9'-xanthene]?
The IUPAC name of spiro[pyrrolidine-3,9'-xanthene] (CID 10444168) is spiro[pyrrolidine-3,9'-xanthene].
What is the SMILES notation for spiro[pyrrolidine-3,9'-xanthene]?
The canonical SMILES for spiro[pyrrolidine-3,9'-xanthene] is c1ccc2c(c1)Oc1ccccc1C21CCNC1.
What is the InChIKey of spiro[pyrrolidine-3,9'-xanthene]?
The InChIKey is YMGYTLOMZJSEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-3-7-14-12(5-1)16(9-10-17-11-16)13-6-2-4-8-15(13)18-14/h1-8,17H,9-11H2.
What are the key properties of spiro[pyrrolidine-3,9'-xanthene]?
spiro[pyrrolidine-3,9'-xanthene] has a molecular weight of 237.30 g/mol, XLogP of 3.07, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[pyrrolidine-3,9'-xanthene] is sourced from PubChem (CID 10444168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).