8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol

C19H19NO3 — CID 5318825

IUPAC8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol
SMILESCOc1cc2c(cc1O)[nH]c1c3c(c(C)cc12)OC(C)(C)C=C3
InChIInChI=1S/C19H19NO3/c1-10-7-13-12-8-16(22-4)15(21)9-14(12)20-17(13)11-5-6-19(2,3)23-18(10)11/h5-9,20-21H,1-4H3
InChIKeyCZZZOTXCAIDYOZ-UHFFFAOYSA-N
MW309.37 g/mol
LogP4.53
Rot. Bonds1

About 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol

8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol (PubChem CID 5318825) has the molecular formula C19H19NO3 and a molecular weight of 309.37 g/mol. Its IUPAC name is 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol.

Molecular Properties

Compound Name8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol
PubChem CID5318825
Molecular FormulaC19H19NO3
Molecular Weight309.37 g/mol
Exact Mass309.14
IUPAC Name8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol
SMILESCOc1cc2c(cc1O)[nH]c1c3c(c(C)cc12)OC(C)(C)C=C3
InChIInChI=1S/C19H19NO3/c1-10-7-13-12-8-16(22-4)15(21)9-14(12)20-17(13)11-5-6-19(2,3)23-18(10)11/h5-9,20-21H,1-4H3
InChIKeyCZZZOTXCAIDYOZ-UHFFFAOYSA-N
XLogP4.53
TPSA54.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-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 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol?
The IUPAC name of 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol (CID 5318825) is 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol.
What is the SMILES notation for 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol?
The canonical SMILES for 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol is COc1cc2c(cc1O)[nH]c1c3c(c(C)cc12)OC(C)(C)C=C3.
What is the InChIKey of 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol?
The InChIKey is CZZZOTXCAIDYOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c1-10-7-13-12-8-16(22-4)15(21)9-14(12)20-17(13)11-5-6-19(2,3)23-18(10)11/h5-9,20-21H,1-4H3.
What are the key properties of 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol?
8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol has a molecular weight of 309.37 g/mol, XLogP of 4.53, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol is sourced from PubChem (CID 5318825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).