4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]

C19H22N2O — CID 86771004

IUPAC4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]
SMILESc1ccc(CCN2CCOC3(CCc4ccccc43)C2)nc1
InChIInChI=1S/C19H22N2O/c1-2-7-18-16(5-1)8-10-19(18)15-21(13-14-22-19)12-9-17-6-3-4-11-20-17/h1-7,11H,8-10,12-15H2
InChIKeySDVBMTWDSIFQKD-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.80
Rot. Bonds3

About 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]

4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine] (PubChem CID 86771004) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine].

Molecular Properties

Compound Name4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]
PubChem CID86771004
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC Name4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]
SMILESc1ccc(CCN2CCOC3(CCc4ccccc43)C2)nc1
InChIInChI=1S/C19H22N2O/c1-2-7-18-16(5-1)8-10-19(18)15-21(13-14-22-19)12-9-17-6-3-4-11-20-17/h1-7,11H,8-10,12-15H2
InChIKeySDVBMTWDSIFQKD-UHFFFAOYSA-N
XLogP2.80
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]?
The IUPAC name of 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine] (CID 86771004) is 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine].
What is the SMILES notation for 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]?
The canonical SMILES for 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine] is c1ccc(CCN2CCOC3(CCc4ccccc43)C2)nc1.
What is the InChIKey of 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]?
The InChIKey is SDVBMTWDSIFQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c1-2-7-18-16(5-1)8-10-19(18)15-21(13-14-22-19)12-9-17-6-3-4-11-20-17/h1-7,11H,8-10,12-15H2.
What are the key properties of 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine]?
4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine] has a molecular weight of 294.40 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4'-(2-pyridin-2-ylethyl)spiro[1,2-dihydroindene-3,2'-morpholine] is sourced from PubChem (CID 86771004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).