4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine

C15H19NO — CID 134969001

IUPAC4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine
SMILESc1ccc2c(c1)CC[C@]21C[C@H]1N1CCOCC1
InChIInChI=1S/C15H19NO/c1-2-4-13-12(3-1)5-6-15(13)11-14(15)16-7-9-17-10-8-16/h1-4,14H,5-11H2/t14-,15+/m1/s1
InChIKeyKEKRZUYSDLFJOL-CABCVRRESA-N
MW229.32 g/mol
LogP1.98
Rot. Bonds1

About 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine

4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine (PubChem CID 134969001) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine.

Molecular Properties

Compound Name4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine
PubChem CID134969001
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine
SMILESc1ccc2c(c1)CC[C@]21C[C@H]1N1CCOCC1
InChIInChI=1S/C15H19NO/c1-2-4-13-12(3-1)5-6-15(13)11-14(15)16-7-9-17-10-8-16/h1-4,14H,5-11H2/t14-,15+/m1/s1
InChIKeyKEKRZUYSDLFJOL-CABCVRRESA-N
XLogP1.98
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine?
The IUPAC name of 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine (CID 134969001) is 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine.
What is the SMILES notation for 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine?
The canonical SMILES for 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine is c1ccc2c(c1)CC[C@]21C[C@H]1N1CCOCC1.
What is the InChIKey of 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine?
The InChIKey is KEKRZUYSDLFJOL-CABCVRRESA-N. The full InChI is InChI=1S/C15H19NO/c1-2-4-13-12(3-1)5-6-15(13)11-14(15)16-7-9-17-10-8-16/h1-4,14H,5-11H2/t14-,15+/m1/s1.
What are the key properties of 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine?
4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine has a molecular weight of 229.32 g/mol, XLogP of 1.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1'R,3S)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]morpholine is sourced from PubChem (CID 134969001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).