1,2,3,11-tetrahydrobenzo[a]carbazol-4-one

C16H13NO — CID 11694344

IUPAC1,2,3,11-tetrahydrobenzo[a]carbazol-4-one
SMILESO=C1CCCc2c1ccc1c2[nH]c2ccccc21
InChIInChI=1S/C16H13NO/c18-15-7-3-5-12-11(15)8-9-13-10-4-1-2-6-14(10)17-16(12)13/h1-2,4,6,8-9,17H,3,5,7H2
InChIKeyFPVYVGVUVHRTJH-UHFFFAOYSA-N
MW235.29 g/mol
LogP3.84
Rot. Bonds

About 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one

1,2,3,11-tetrahydrobenzo[a]carbazol-4-one (PubChem CID 11694344) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one.

Molecular Properties

Compound Name1,2,3,11-tetrahydrobenzo[a]carbazol-4-one
PubChem CID11694344
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name1,2,3,11-tetrahydrobenzo[a]carbazol-4-one
SMILESO=C1CCCc2c1ccc1c2[nH]c2ccccc21
InChIInChI=1S/C16H13NO/c18-15-7-3-5-12-11(15)8-9-13-10-4-1-2-6-14(10)17-16(12)13/h1-2,4,6,8-9,17H,3,5,7H2
InChIKeyFPVYVGVUVHRTJH-UHFFFAOYSA-N
XLogP3.84
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one 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 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one?
The IUPAC name of 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one (CID 11694344) is 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one.
What is the SMILES notation for 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one?
The canonical SMILES for 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one is O=C1CCCc2c1ccc1c2[nH]c2ccccc21.
What is the InChIKey of 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one?
The InChIKey is FPVYVGVUVHRTJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c18-15-7-3-5-12-11(15)8-9-13-10-4-1-2-6-14(10)17-16(12)13/h1-2,4,6,8-9,17H,3,5,7H2.
What are the key properties of 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one?
1,2,3,11-tetrahydrobenzo[a]carbazol-4-one has a molecular weight of 235.29 g/mol, XLogP of 3.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,11-tetrahydrobenzo[a]carbazol-4-one is sourced from PubChem (CID 11694344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).