5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine

C37H34N2 — CID 168782836

IUPAC5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine
SMILESCC(C)(C)c1ccc(N2c3ccccc3N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccccc32)cc1
InChIInChI=1S/C37H34N2/c1-36(2,3)25-18-20-26(21-19-25)38-32-14-8-10-16-34(32)39(35-17-11-9-15-33(35)38)27-22-23-29-28-12-6-7-13-30(28)37(4,5)31(29)24-27/h6-24H,1-5H3
InChIKeyALMNGZBNQISJFA-UHFFFAOYSA-N
MW506.69 g/mol
LogP10.54
Rot. Bonds2

About 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine

5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine (PubChem CID 168782836) has the molecular formula C37H34N2 and a molecular weight of 506.69 g/mol. Its IUPAC name is 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine.

Molecular Properties

Compound Name5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine
PubChem CID168782836
Molecular FormulaC37H34N2
Molecular Weight506.69 g/mol
Exact Mass506.27
IUPAC Name5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine
SMILESCC(C)(C)c1ccc(N2c3ccccc3N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccccc32)cc1
InChIInChI=1S/C37H34N2/c1-36(2,3)25-18-20-26(21-19-25)38-32-14-8-10-16-34(32)39(35-17-11-9-15-33(35)38)27-22-23-29-28-12-6-7-13-30(28)37(4,5)31(29)24-27/h6-24H,1-5H3
InChIKeyALMNGZBNQISJFA-UHFFFAOYSA-N
XLogP10.54
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.69
LogP ≤ 510.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

10-[7-[10-(4-tert-butylphenyl)phenazin-5-yl]-9,9-dimethylfluoren-2-yl]phenoxazine
CID 168782831
12,27-bis(9,9-dimethylfluoren-2-yl)-12,27-diazaheptacyclo[26.2.2.28,11.213,16.223,26.02,7.017,22]octatriaconta-1(30),2,4,6,8(38),9,11(37),13(36),14,16(35),17,19,21,23,25,28,31,33-octadecaene
CID 121263135
8,14-bis(9,9-dimethylfluoren-2-yl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9(21),10,12,15,17,19-nonaene
CID 153317294
10-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylacridine
CID 155244755
11,18-ditert-butyl-N,N,8-tris(4-tert-butylphenyl)-14-(9,9-dimethylfluoren-2-yl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaen-5-amine
CID 171764744
9,9-dimethyl-10-(3,7,7'-tritert-butyl-5,5'-spirobi[benzo[b][1]benzogermole]-3'-yl)acridine
CID 166025201
2-tert-butyl-10-[7'-(2-tert-butyl-9,9-dimethylacridin-10-yl)-9,9'-spirobi[fluorene]-2'-yl]-9-ethyl-9-methylacridine
CID 144530914
18-tert-butyl-14-(4-tert-butylphenyl)-8-(9,9-dimethylfluoren-2-yl)-N-phenyl-N-(4-phenylphenyl)-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15(20),16,18-nonaen-5-amine
CID 175623789
5-(4-tert-butylphenyl)-10-phenylphenazine
CID 90180989
10-[14-(9,9-dimethylfluoren-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl]-14-naphthalen-2-yl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 122659751
9-(9,9-dimethylfluoren-1-yl)-10-(9,9-dimethylfluoren-2-yl)-9-phenylacridine
CID 153463086
11,17-ditert-butyl-14-(9,9-dimethylfluoren-2-yl)-4-(2-methylphenyl)-8-[4-(2-methylphenyl)phenyl]-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaene
CID 176635294

Frequently Asked Questions

What is the IUPAC name of 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine?
The IUPAC name of 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine (CID 168782836) is 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine.
What is the SMILES notation for 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine?
The canonical SMILES for 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine is CC(C)(C)c1ccc(N2c3ccccc3N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccccc32)cc1.
What is the InChIKey of 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine?
The InChIKey is ALMNGZBNQISJFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H34N2/c1-36(2,3)25-18-20-26(21-19-25)38-32-14-8-10-16-34(32)39(35-17-11-9-15-33(35)38)27-22-23-29-28-12-6-7-13-30(28)37(4,5)31(29)24-27/h6-24H,1-5H3.
What are the key properties of 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine?
5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine has a molecular weight of 506.69 g/mol, XLogP of 10.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-tert-butylphenyl)-10-(9,9-dimethylfluoren-2-yl)phenazine is sourced from PubChem (CID 168782836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).