1,2,5,8-tetramethoxy-9H-carbazole

C16H17NO4 — CID 171715062

IUPAC1,2,5,8-tetramethoxy-9H-carbazole
SMILESCOc1ccc2c([nH]c3c(OC)ccc(OC)c32)c1OC
InChIInChI=1S/C16H17NO4/c1-18-10-7-8-11(19-2)15-13(10)9-5-6-12(20-3)16(21-4)14(9)17-15/h5-8,17H,1-4H3
InChIKeyXVUYRKXGHSSBLR-UHFFFAOYSA-N
MW287.31 g/mol
LogP3.36
Rot. Bonds4

About 1,2,5,8-tetramethoxy-9H-carbazole

1,2,5,8-tetramethoxy-9H-carbazole (PubChem CID 171715062) has the molecular formula C16H17NO4 and a molecular weight of 287.31 g/mol. Its IUPAC name is 1,2,5,8-tetramethoxy-9H-carbazole.

Molecular Properties

Compound Name1,2,5,8-tetramethoxy-9H-carbazole
PubChem CID171715062
Molecular FormulaC16H17NO4
Molecular Weight287.31 g/mol
Exact Mass287.12
IUPAC Name1,2,5,8-tetramethoxy-9H-carbazole
SMILESCOc1ccc2c([nH]c3c(OC)ccc(OC)c32)c1OC
InChIInChI=1S/C16H17NO4/c1-18-10-7-8-11(19-2)15-13(10)9-5-6-12(20-3)16(21-4)14(9)17-15/h5-8,17H,1-4H3
InChIKeyXVUYRKXGHSSBLR-UHFFFAOYSA-N
XLogP3.36
TPSA52.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.31
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2,5,8-tetramethoxy-9H-carbazole?
The IUPAC name of 1,2,5,8-tetramethoxy-9H-carbazole (CID 171715062) is 1,2,5,8-tetramethoxy-9H-carbazole.
What is the SMILES notation for 1,2,5,8-tetramethoxy-9H-carbazole?
The canonical SMILES for 1,2,5,8-tetramethoxy-9H-carbazole is COc1ccc2c([nH]c3c(OC)ccc(OC)c32)c1OC.
What is the InChIKey of 1,2,5,8-tetramethoxy-9H-carbazole?
The InChIKey is XVUYRKXGHSSBLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO4/c1-18-10-7-8-11(19-2)15-13(10)9-5-6-12(20-3)16(21-4)14(9)17-15/h5-8,17H,1-4H3.
What are the key properties of 1,2,5,8-tetramethoxy-9H-carbazole?
1,2,5,8-tetramethoxy-9H-carbazole has a molecular weight of 287.31 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5,8-tetramethoxy-9H-carbazole is sourced from PubChem (CID 171715062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).