5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium

C19H12N+ — CID 159717785

IUPAC5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium
SMILES[C+]1=Cc2[nH]c3cc4c(cc3c2C=C1)Cc1ccccc1-4
InChIInChI=1S/C19H12N/c1-2-6-14-12(5-1)9-13-10-17-15-7-3-4-8-18(15)20-19(17)11-16(13)14/h1-3,5-8,10-11,20H,9H2/q+1
InChIKeyUGZHXQQRIZIHHC-UHFFFAOYSA-N
MW254.31 g/mol
LogP4.58
Rot. Bonds

About 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium

5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium (PubChem CID 159717785) has the molecular formula C19H12N+ and a molecular weight of 254.31 g/mol. Its IUPAC name is 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium.

Molecular Properties

Compound Name5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium
PubChem CID159717785
Molecular FormulaC19H12N+
Molecular Weight254.31 g/mol
Exact Mass254.10
IUPAC Name5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium
SMILES[C+]1=Cc2[nH]c3cc4c(cc3c2C=C1)Cc1ccccc1-4
InChIInChI=1S/C19H12N/c1-2-6-14-12(5-1)9-13-10-17-15-7-3-4-8-18(15)20-19(17)11-16(13)14/h1-3,5-8,10-11,20H,9H2/q+1
InChIKeyUGZHXQQRIZIHHC-UHFFFAOYSA-N
XLogP4.58
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

2-methyl-5,11-dihydroindeno[1,2-b]carbazole
CID 146579673
nonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4(16),5,8,10,12,14,19,21(33),22,25,27,29,31-pentadecaene
CID 59863436
12-azahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 118488485
ethane;hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(14),2,4,6,8,10,12,15,17,19,21,24-dodecaene
CID 160763232
9H-carbazole;bis(9H-fluorene)
CID 158703465
15-azaoctacyclo[18.11.0.02,14.04,12.05,10.015,19.022,30.023,28]hentriaconta-1(20),2(14),3,5,7,9,12,16,18,21,23,25,27,30-tetradecaene
CID 157310210
undecacyclo[13.13.13.02,14.04,12.05,10.016,28.018,26.020,25.029,41.031,39.032,37]hentetraconta-2(14),3,5,7,9,12,16(28),17,20,22,24,26,29(41),30,32,34,36,39-octadecaene
CID 132604363
5,12-dihydronaphtho[3,2-b]acridine-7,14-dione
CID 59787127
9H-fluorene;oxophosphane
CID 174601741
spiro[12H-indeno[2,1-b]fluorene-10,7'-5H-indeno[2,1-b]carbazole]
CID 159125912
cadmium;9H-fluorene
CID 175337736
azane;hexakis(9H-fluorene)
CID 158472914

Frequently Asked Questions

What is the IUPAC name of 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium?
The IUPAC name of 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium (CID 159717785) is 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium.
What is the SMILES notation for 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium?
The canonical SMILES for 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium is [C+]1=Cc2[nH]c3cc4c(cc3c2C=C1)Cc1ccccc1-4.
What is the InChIKey of 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium?
The InChIKey is UGZHXQQRIZIHHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N/c1-2-6-14-12(5-1)9-13-10-17-15-7-3-4-8-18(15)20-19(17)11-16(13)14/h1-3,5-8,10-11,20H,9H2/q+1.
What are the key properties of 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium?
5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium has a molecular weight of 254.31 g/mol, XLogP of 4.58, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,11-dihydro-3H-indeno[1,2-b]carbazol-3-ylium is sourced from PubChem (CID 159717785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).