2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one

C19H25NO — CID 72550901

IUPAC2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one
SMILESCC1=CC(C)(C)N=C2CC3(C(C)C)CC(=O)C(C)=C3C=C12
InChIInChI=1S/C19H25NO/c1-11(2)19-9-16-14(12(3)8-18(5,6)20-16)7-15(19)13(4)17(21)10-19/h7-8,11H,9-10H2,1-6H3
InChIKeyPOKVERZIRYPQDM-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.43
Rot. Bonds1

About 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one

2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one (PubChem CID 72550901) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one.

Molecular Properties

Compound Name2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one
PubChem CID72550901
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one
SMILESCC1=CC(C)(C)N=C2CC3(C(C)C)CC(=O)C(C)=C3C=C12
InChIInChI=1S/C19H25NO/c1-11(2)19-9-16-14(12(3)8-18(5,6)20-16)7-15(19)13(4)17(21)10-19/h7-8,11H,9-10H2,1-6H3
InChIKeyPOKVERZIRYPQDM-UHFFFAOYSA-N
XLogP4.43
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-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 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one?
The IUPAC name of 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one (CID 72550901) is 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one.
What is the SMILES notation for 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one?
The canonical SMILES for 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one is CC1=CC(C)(C)N=C2CC3(C(C)C)CC(=O)C(C)=C3C=C12.
What is the InChIKey of 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one?
The InChIKey is POKVERZIRYPQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-11(2)19-9-16-14(12(3)8-18(5,6)20-16)7-15(19)13(4)17(21)10-19/h7-8,11H,9-10H2,1-6H3.
What are the key properties of 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one?
2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one has a molecular weight of 283.42 g/mol, XLogP of 4.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,6-tetramethyl-8a-propan-2-yl-8,9-dihydrocyclopenta[g]quinolin-7-one is sourced from PubChem (CID 72550901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).