4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole

C16H15NO4 — CID 171714830

IUPAC4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole
SMILESCOc1cc2c([nH]c3c(OC)c(C)ccc32)c2c1OCO2
InChIInChI=1S/C16H15NO4/c1-8-4-5-9-10-6-11(18-2)15-16(21-7-20-15)13(10)17-12(9)14(8)19-3/h4-6,17H,7H2,1-3H3
InChIKeySABYPUSKHZCSJP-UHFFFAOYSA-N
MW285.30 g/mol
LogP3.38
Rot. Bonds2

About 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole

4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole (PubChem CID 171714830) has the molecular formula C16H15NO4 and a molecular weight of 285.30 g/mol. Its IUPAC name is 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole.

Molecular Properties

Compound Name4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole
PubChem CID171714830
Molecular FormulaC16H15NO4
Molecular Weight285.30 g/mol
Exact Mass285.10
IUPAC Name4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole
SMILESCOc1cc2c([nH]c3c(OC)c(C)ccc32)c2c1OCO2
InChIInChI=1S/C16H15NO4/c1-8-4-5-9-10-6-11(18-2)15-16(21-7-20-15)13(10)17-12(9)14(8)19-3/h4-6,17H,7H2,1-3H3
InChIKeySABYPUSKHZCSJP-UHFFFAOYSA-N
XLogP3.38
TPSA52.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole?
The IUPAC name of 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole (CID 171714830) is 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole.
What is the SMILES notation for 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole?
The canonical SMILES for 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole is COc1cc2c([nH]c3c(OC)c(C)ccc32)c2c1OCO2.
What is the InChIKey of 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole?
The InChIKey is SABYPUSKHZCSJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO4/c1-8-4-5-9-10-6-11(18-2)15-16(21-7-20-15)13(10)17-12(9)14(8)19-3/h4-6,17H,7H2,1-3H3.
What are the key properties of 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole?
4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole has a molecular weight of 285.30 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,9-dimethoxy-8-methyl-10H-[1,3]dioxolo[4,5-a]carbazole is sourced from PubChem (CID 171714830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).