9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone

C25H16N2O — CID 102428595

IUPAC9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone
SMILESO=C(c1ccc2c(c1)Cc1ccccc1-2)c1nccc2c1[nH]c1ccccc12
InChIInChI=1S/C25H16N2O/c28-25(16-9-10-19-17(14-16)13-15-5-1-2-6-18(15)19)24-23-21(11-12-26-24)20-7-3-4-8-22(20)27-23/h1-12,14,27H,13H2
InChIKeyXVWBRKULKXIICZ-UHFFFAOYSA-N
MW360.42 g/mol
LogP5.52
Rot. Bonds2

About 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone

9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone (PubChem CID 102428595) has the molecular formula C25H16N2O and a molecular weight of 360.42 g/mol. Its IUPAC name is 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone.

Molecular Properties

Compound Name9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone
PubChem CID102428595
Molecular FormulaC25H16N2O
Molecular Weight360.42 g/mol
Exact Mass360.13
IUPAC Name9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone
SMILESO=C(c1ccc2c(c1)Cc1ccccc1-2)c1nccc2c1[nH]c1ccccc12
InChIInChI=1S/C25H16N2O/c28-25(16-9-10-19-17(14-16)13-15-5-1-2-6-18(15)19)24-23-21(11-12-26-24)20-7-3-4-8-22(20)27-23/h1-12,14,27H,13H2
InChIKeyXVWBRKULKXIICZ-UHFFFAOYSA-N
XLogP5.52
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.42
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(4-fluorophenyl)phenyl]-(9H-pyrido[3,4-b]indol-1-yl)methanone
CID 15946501
[3-(9H-fluorene-2-carbonyl)phenyl]-(9H-fluoren-2-yl)methanone
CID 10552019
9H-fluoren-2-yl-(4-phenylphenyl)methanone
CID 91678788
9H-carbazole;bis(9H-fluorene)
CID 158703465
2-(9H-fluoren-1-yl)-9H-carbazol-1-amine
CID 172636197
7,12-dihydroindeno[1,2-a]carbazole
CID 58472013
1-(9H-fluoren-2-yl)-2-isoquinolin-1-ylethanone
CID 53443148
1-(9H-fluoren-2-yl)-3-phenylpropane-1,3-dione
CID 132527641
9H-fluoren-2-yl(9,9'-spirobi[fluorene]-2-yl)methanone
CID 146631569
9H-fluorene-2-carboxamide;hydrochloride
CID 21224790
1-(4-pyridin-4-yl-2-pyridinyl)-9H-carbazole
CID 141396420
9H-pyrido[3,4-b]indol-1-yl carbamate
CID 91488177

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone?
The IUPAC name of 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone (CID 102428595) is 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone.
What is the SMILES notation for 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone?
The canonical SMILES for 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone is O=C(c1ccc2c(c1)Cc1ccccc1-2)c1nccc2c1[nH]c1ccccc12.
What is the InChIKey of 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone?
The InChIKey is XVWBRKULKXIICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16N2O/c28-25(16-9-10-19-17(14-16)13-15-5-1-2-6-18(15)19)24-23-21(11-12-26-24)20-7-3-4-8-22(20)27-23/h1-12,14,27H,13H2.
What are the key properties of 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone?
9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone has a molecular weight of 360.42 g/mol, XLogP of 5.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-2-yl(9H-pyrido[3,4-b]indol-1-yl)methanone is sourced from PubChem (CID 102428595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).