12H-naphtho[3,2-a]carbazole-5,13-dione

C20H11NO2 — CID 24241

IUPAC12H-naphtho[3,2-a]carbazole-5,13-dione
SMILESO=C1c2ccccc2C(=O)c2c1ccc1c2[nH]c2ccccc21
InChIInChI=1S/C20H11NO2/c22-19-13-6-1-2-7-14(13)20(23)17-15(19)10-9-12-11-5-3-4-8-16(11)21-18(12)17/h1-10,21H
InChIKeyJKKLCMHYJFHIOQ-UHFFFAOYSA-N
MW297.31 g/mol
LogP4.10
Rot. Bonds

About 12H-naphtho[3,2-a]carbazole-5,13-dione

12H-naphtho[3,2-a]carbazole-5,13-dione (PubChem CID 24241) has the molecular formula C20H11NO2 and a molecular weight of 297.31 g/mol. Its IUPAC name is 12H-naphtho[3,2-a]carbazole-5,13-dione.

Molecular Properties

Compound Name12H-naphtho[3,2-a]carbazole-5,13-dione
PubChem CID24241
Molecular FormulaC20H11NO2
Molecular Weight297.31 g/mol
Exact Mass297.08
IUPAC Name12H-naphtho[3,2-a]carbazole-5,13-dione
SMILESO=C1c2ccccc2C(=O)c2c1ccc1c2[nH]c2ccccc21
InChIInChI=1S/C20H11NO2/c22-19-13-6-1-2-7-14(13)20(23)17-15(19)10-9-12-11-5-3-4-8-16(11)21-18(12)17/h1-10,21H
InChIKeyJKKLCMHYJFHIOQ-UHFFFAOYSA-N
XLogP4.10
TPSA49.93 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

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Related Compounds

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Vat Brown 1
CID 62448
(4-Ethylnaphthalen-1-yl)-(2-methyl-1-pentylindol-3-yl)methanone
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2-Phenylindole-3-carboxaldehyde
CID 613305
Dinaphtho(2,3-i:2',3'-i')benzo(1,2-a:4,5-a')dicarbazole-5,7,12,17,19,24(6H,18H)-hexone
CID 75113
Jwh-149
CID 45267820
(2-methyl-1-pentyl-1H-indol-3-yl)(4-propylnaphthalen-1-yl)methanone
CID 45272121
1-(2-Phenyl-1H-indol-3-yl)ethanone
CID 613364
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CID 44368310

Frequently Asked Questions

What is the IUPAC name of 12H-naphtho[3,2-a]carbazole-5,13-dione?
The IUPAC name of 12H-naphtho[3,2-a]carbazole-5,13-dione (CID 24241) is 12H-naphtho[3,2-a]carbazole-5,13-dione.
What is the SMILES notation for 12H-naphtho[3,2-a]carbazole-5,13-dione?
The canonical SMILES for 12H-naphtho[3,2-a]carbazole-5,13-dione is O=C1c2ccccc2C(=O)c2c1ccc1c2[nH]c2ccccc21.
What is the InChIKey of 12H-naphtho[3,2-a]carbazole-5,13-dione?
The InChIKey is JKKLCMHYJFHIOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11NO2/c22-19-13-6-1-2-7-14(13)20(23)17-15(19)10-9-12-11-5-3-4-8-16(11)21-18(12)17/h1-10,21H.
What are the key properties of 12H-naphtho[3,2-a]carbazole-5,13-dione?
12H-naphtho[3,2-a]carbazole-5,13-dione has a molecular weight of 297.31 g/mol, XLogP of 4.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12H-naphtho[3,2-a]carbazole-5,13-dione is sourced from PubChem (CID 24241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).