3-methoxy-5H-[1]benzofuro[3,2-c]carbazole

C19H13NO2 — CID 166491706

IUPAC3-methoxy-5H-[1]benzofuro[3,2-c]carbazole
SMILESCOc1ccc2c(c1)[nH]c1ccc3c4ccccc4oc3c12
InChIInChI=1S/C19H13NO2/c1-21-11-6-7-14-16(10-11)20-15-9-8-13-12-4-2-3-5-17(12)22-19(13)18(14)15/h2-10,20H,1H3
InChIKeyGEGQLKBSDRGNSQ-UHFFFAOYSA-N
MW287.32 g/mol
LogP5.23
Rot. Bonds1

About 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole

3-methoxy-5H-[1]benzofuro[3,2-c]carbazole (PubChem CID 166491706) has the molecular formula C19H13NO2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole.

Molecular Properties

Compound Name3-methoxy-5H-[1]benzofuro[3,2-c]carbazole
PubChem CID166491706
Molecular FormulaC19H13NO2
Molecular Weight287.32 g/mol
Exact Mass287.09
IUPAC Name3-methoxy-5H-[1]benzofuro[3,2-c]carbazole
SMILESCOc1ccc2c(c1)[nH]c1ccc3c4ccccc4oc3c12
InChIInChI=1S/C19H13NO2/c1-21-11-6-7-14-16(10-11)20-15-9-8-13-12-4-2-3-5-17(12)22-19(13)18(14)15/h2-10,20H,1H3
InChIKeyGEGQLKBSDRGNSQ-UHFFFAOYSA-N
XLogP5.23
TPSA38.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.32
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole?
The IUPAC name of 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole (CID 166491706) is 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole.
What is the SMILES notation for 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole?
The canonical SMILES for 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole is COc1ccc2c(c1)[nH]c1ccc3c4ccccc4oc3c12.
What is the InChIKey of 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole?
The InChIKey is GEGQLKBSDRGNSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO2/c1-21-11-6-7-14-16(10-11)20-15-9-8-13-12-4-2-3-5-17(12)22-19(13)18(14)15/h2-10,20H,1H3.
What are the key properties of 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole?
3-methoxy-5H-[1]benzofuro[3,2-c]carbazole has a molecular weight of 287.32 g/mol, XLogP of 5.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-5H-[1]benzofuro[3,2-c]carbazole is sourced from PubChem (CID 166491706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).