1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one

C23H24N4O — CID 71044496

IUPAC1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one
SMILESCc1nc2c3c(c(N4CCCC4=O)cc2[nH]1)CCC1(Cc2ccccc2C1)N3
InChIInChI=1S/C23H24N4O/c1-14-24-18-11-19(27-10-4-7-20(27)28)17-8-9-23(26-21(17)22(18)25-14)12-15-5-2-3-6-16(15)13-23/h2-3,5-6,11,26H,4,7-10,12-13H2,1H3,(H,24,25)
InChIKeyGXCNVOLQMUZTQZ-UHFFFAOYSA-N
MW372.47 g/mol
LogP3.89
Rot. Bonds1

About 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one

1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one (PubChem CID 71044496) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one
PubChem CID71044496
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one
SMILESCc1nc2c3c(c(N4CCCC4=O)cc2[nH]1)CCC1(Cc2ccccc2C1)N3
InChIInChI=1S/C23H24N4O/c1-14-24-18-11-19(27-10-4-7-20(27)28)17-8-9-23(26-21(17)22(18)25-14)12-15-5-2-3-6-16(15)13-23/h2-3,5-6,11,26H,4,7-10,12-13H2,1H3,(H,24,25)
InChIKeyGXCNVOLQMUZTQZ-UHFFFAOYSA-N
XLogP3.89
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one?
The IUPAC name of 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one (CID 71044496) is 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one is Cc1nc2c3c(c(N4CCCC4=O)cc2[nH]1)CCC1(Cc2ccccc2C1)N3.
What is the InChIKey of 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one?
The InChIKey is GXCNVOLQMUZTQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O/c1-14-24-18-11-19(27-10-4-7-20(27)28)17-8-9-23(26-21(17)22(18)25-14)12-15-5-2-3-6-16(15)13-23/h2-3,5-6,11,26H,4,7-10,12-13H2,1H3,(H,24,25).
What are the key properties of 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one?
1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one has a molecular weight of 372.47 g/mol, XLogP of 3.89, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-yl)pyrrolidin-2-one is sourced from PubChem (CID 71044496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).