6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol

C32H29N3O2 — CID 176605977

IUPAC6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
SMILESCC(C)c1cc(O)c2nc(Oc3ccc4c5cccc(C(C)C)c5n(-c5ccccn5)c4c3)ccc2c1
InChIInChI=1S/C32H29N3O2/c1-19(2)22-16-21-11-14-30(34-31(21)28(36)17-22)37-23-12-13-25-26-9-7-8-24(20(3)4)32(26)35(27(25)18-23)29-10-5-6-15-33-29/h5-20,36H,1-4H3
InChIKeySYVNVHNCPWBBPN-UHFFFAOYSA-N
MW487.60 g/mol
LogP8.47
Rot. Bonds5

About 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol

6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol (PubChem CID 176605977) has the molecular formula C32H29N3O2 and a molecular weight of 487.60 g/mol. Its IUPAC name is 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol.

Molecular Properties

Compound Name6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
PubChem CID176605977
Molecular FormulaC32H29N3O2
Molecular Weight487.60 g/mol
Exact Mass487.23
IUPAC Name6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
SMILESCC(C)c1cc(O)c2nc(Oc3ccc4c5cccc(C(C)C)c5n(-c5ccccn5)c4c3)ccc2c1
InChIInChI=1S/C32H29N3O2/c1-19(2)22-16-21-11-14-30(34-31(21)28(36)17-22)37-23-12-13-25-26-9-7-8-24(20(3)4)32(26)35(27(25)18-23)29-10-5-6-15-33-29/h5-20,36H,1-4H3
InChIKeySYVNVHNCPWBBPN-UHFFFAOYSA-N
XLogP8.47
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms37
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.60
LogP ≤ 58.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol 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 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
The IUPAC name of 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol (CID 176605977) is 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol.
What is the SMILES notation for 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
The canonical SMILES for 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol is CC(C)c1cc(O)c2nc(Oc3ccc4c5cccc(C(C)C)c5n(-c5ccccn5)c4c3)ccc2c1.
What is the InChIKey of 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
The InChIKey is SYVNVHNCPWBBPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H29N3O2/c1-19(2)22-16-21-11-14-30(34-31(21)28(36)17-22)37-23-12-13-25-26-9-7-8-24(20(3)4)32(26)35(27(25)18-23)29-10-5-6-15-33-29/h5-20,36H,1-4H3.
What are the key properties of 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol?
6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol has a molecular weight of 487.60 g/mol, XLogP of 8.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-2-(8-propan-2-yl-9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol is sourced from PubChem (CID 176605977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).