5-methyl-12H-[1]benzofuro[2,3-a]carbazole

C19H13NO — CID 86045140

IUPAC5-methyl-12H-[1]benzofuro[2,3-a]carbazole
SMILESCc1cc2c3ccccc3oc2c2[nH]c3ccccc3c12
InChIInChI=1S/C19H13NO/c1-11-10-14-12-6-3-5-9-16(12)21-19(14)18-17(11)13-7-2-4-8-15(13)20-18/h2-10,20H,1H3
InChIKeyYUCYJAHPGLUJRL-UHFFFAOYSA-N
MW271.32 g/mol
LogP5.53
Rot. Bonds

About 5-methyl-12H-[1]benzofuro[2,3-a]carbazole

5-methyl-12H-[1]benzofuro[2,3-a]carbazole (PubChem CID 86045140) has the molecular formula C19H13NO and a molecular weight of 271.32 g/mol. Its IUPAC name is 5-methyl-12H-[1]benzofuro[2,3-a]carbazole.

Molecular Properties

Compound Name5-methyl-12H-[1]benzofuro[2,3-a]carbazole
PubChem CID86045140
Molecular FormulaC19H13NO
Molecular Weight271.32 g/mol
Exact Mass271.10
IUPAC Name5-methyl-12H-[1]benzofuro[2,3-a]carbazole
SMILESCc1cc2c3ccccc3oc2c2[nH]c3ccccc3c12
InChIInChI=1S/C19H13NO/c1-11-10-14-12-6-3-5-9-16(12)21-19(14)18-17(11)13-7-2-4-8-15(13)20-18/h2-10,20H,1H3
InChIKeyYUCYJAHPGLUJRL-UHFFFAOYSA-N
XLogP5.53
TPSA28.93 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500271.32
LogP ≤ 55.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-12H-[1]benzofuro[2,3-a]carbazole?
The IUPAC name of 5-methyl-12H-[1]benzofuro[2,3-a]carbazole (CID 86045140) is 5-methyl-12H-[1]benzofuro[2,3-a]carbazole.
What is the SMILES notation for 5-methyl-12H-[1]benzofuro[2,3-a]carbazole?
The canonical SMILES for 5-methyl-12H-[1]benzofuro[2,3-a]carbazole is Cc1cc2c3ccccc3oc2c2[nH]c3ccccc3c12.
What is the InChIKey of 5-methyl-12H-[1]benzofuro[2,3-a]carbazole?
The InChIKey is YUCYJAHPGLUJRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO/c1-11-10-14-12-6-3-5-9-16(12)21-19(14)18-17(11)13-7-2-4-8-15(13)20-18/h2-10,20H,1H3.
What are the key properties of 5-methyl-12H-[1]benzofuro[2,3-a]carbazole?
5-methyl-12H-[1]benzofuro[2,3-a]carbazole has a molecular weight of 271.32 g/mol, XLogP of 5.53, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-12H-[1]benzofuro[2,3-a]carbazole is sourced from PubChem (CID 86045140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).