3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one

C23H25NO — CID 516457

IUPAC3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one
SMILESCCc1ccc2c(c1)-c1c(c(=O)c3ccc(C(C)C)cc3n1CC)C2
InChIInChI=1S/C23H25NO/c1-5-15-7-8-17-12-20-22(19(17)11-15)24(6-2)21-13-16(14(3)4)9-10-18(21)23(20)25/h7-11,13-14H,5-6,12H2,1-4H3
InChIKeyZBWLZBRVXVAMPP-UHFFFAOYSA-N
MW331.46 g/mol
LogP5.28
Rot. Bonds3

About 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one

3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one (PubChem CID 516457) has the molecular formula C23H25NO and a molecular weight of 331.46 g/mol. Its IUPAC name is 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one.

Molecular Properties

Compound Name3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one
PubChem CID516457
Molecular FormulaC23H25NO
Molecular Weight331.46 g/mol
Exact Mass331.19
IUPAC Name3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one
SMILESCCc1ccc2c(c1)-c1c(c(=O)c3ccc(C(C)C)cc3n1CC)C2
InChIInChI=1S/C23H25NO/c1-5-15-7-8-17-12-20-22(19(17)11-15)24(6-2)21-13-16(14(3)4)9-10-18(21)23(20)25/h7-11,13-14H,5-6,12H2,1-4H3
InChIKeyZBWLZBRVXVAMPP-UHFFFAOYSA-N
XLogP5.28
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.46
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one?
The IUPAC name of 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one (CID 516457) is 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one.
What is the SMILES notation for 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one?
The canonical SMILES for 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one is CCc1ccc2c(c1)-c1c(c(=O)c3ccc(C(C)C)cc3n1CC)C2.
What is the InChIKey of 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one?
The InChIKey is ZBWLZBRVXVAMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO/c1-5-15-7-8-17-12-20-22(19(17)11-15)24(6-2)21-13-16(14(3)4)9-10-18(21)23(20)25/h7-11,13-14H,5-6,12H2,1-4H3.
What are the key properties of 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one?
3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one has a molecular weight of 331.46 g/mol, XLogP of 5.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-7-propan-2-yl-11H-indeno[1,2-b]quinolin-10-one is sourced from PubChem (CID 516457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).