1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]

C17H22FNO — CID 118738981

IUPAC1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]
SMILESFc1ccc2c(c1)C1(CCNCC1)CC2OCC1CC1
InChIInChI=1S/C17H22FNO/c18-13-3-4-14-15(9-13)17(5-7-19-8-6-17)10-16(14)20-11-12-1-2-12/h3-4,9,12,16,19H,1-2,5-8,10-11H2
InChIKeyAYGZZKRUIAMILE-UHFFFAOYSA-N
MW275.37 g/mol
LogP3.32
Rot. Bonds3

About 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]

1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine] (PubChem CID 118738981) has the molecular formula C17H22FNO and a molecular weight of 275.37 g/mol. Its IUPAC name is 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine].

Molecular Properties

Compound Name1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]
PubChem CID118738981
Molecular FormulaC17H22FNO
Molecular Weight275.37 g/mol
Exact Mass275.17
IUPAC Name1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]
SMILESFc1ccc2c(c1)C1(CCNCC1)CC2OCC1CC1
InChIInChI=1S/C17H22FNO/c18-13-3-4-14-15(9-13)17(5-7-19-8-6-17)10-16(14)20-11-12-1-2-12/h3-4,9,12,16,19H,1-2,5-8,10-11H2
InChIKeyAYGZZKRUIAMILE-UHFFFAOYSA-N
XLogP3.32
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]?
The IUPAC name of 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine] (CID 118738981) is 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine].
What is the SMILES notation for 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]?
The canonical SMILES for 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine] is Fc1ccc2c(c1)C1(CCNCC1)CC2OCC1CC1.
What is the InChIKey of 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]?
The InChIKey is AYGZZKRUIAMILE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22FNO/c18-13-3-4-14-15(9-13)17(5-7-19-8-6-17)10-16(14)20-11-12-1-2-12/h3-4,9,12,16,19H,1-2,5-8,10-11H2.
What are the key properties of 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]?
1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine] has a molecular weight of 275.37 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethoxy)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine] is sourced from PubChem (CID 118738981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).