6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one

C23H25N3O — CID 24961057

IUPAC6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one
SMILESCC1(C)Nc2c(cc(-c3cccc4nccn34)c3c2CCC3)C(C)(C)C1=O
InChIInChI=1S/C23H25N3O/c1-22(2)17-13-16(18-9-6-10-19-24-11-12-26(18)19)14-7-5-8-15(14)20(17)25-23(3,4)21(22)27/h6,9-13,25H,5,7-8H2,1-4H3
InChIKeyNULJELQRMSFKRP-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.54
Rot. Bonds1

About 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one

6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one (PubChem CID 24961057) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one.

Molecular Properties

Compound Name6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one
PubChem CID24961057
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC Name6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one
SMILESCC1(C)Nc2c(cc(-c3cccc4nccn34)c3c2CCC3)C(C)(C)C1=O
InChIInChI=1S/C23H25N3O/c1-22(2)17-13-16(18-9-6-10-19-24-11-12-26(18)19)14-7-5-8-15(14)20(17)25-23(3,4)21(22)27/h6,9-13,25H,5,7-8H2,1-4H3
InChIKeyNULJELQRMSFKRP-UHFFFAOYSA-N
XLogP4.54
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one?
The IUPAC name of 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one (CID 24961057) is 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one.
What is the SMILES notation for 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one?
The canonical SMILES for 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one is CC1(C)Nc2c(cc(-c3cccc4nccn34)c3c2CCC3)C(C)(C)C1=O.
What is the InChIKey of 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one?
The InChIKey is NULJELQRMSFKRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-22(2)17-13-16(18-9-6-10-19-24-11-12-26(18)19)14-7-5-8-15(14)20(17)25-23(3,4)21(22)27/h6,9-13,25H,5,7-8H2,1-4H3.
What are the key properties of 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one?
6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one has a molecular weight of 359.47 g/mol, XLogP of 4.54, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazo[1,2-a]pyridin-5-yl-2,2,4,4-tetramethyl-1,7,8,9-tetrahydrocyclopenta[h]quinolin-3-one is sourced from PubChem (CID 24961057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).