5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]

C42H26N2 — CID 90335745

IUPAC5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]
SMILESc1ccc(-n2c3ccccc3c3cc4c(cc32)C2(c3ccccc3-c3ccc(-c5ccccn5)cc32)c2ccccc2-4)cc1
InChIInChI=1S/C42H26N2/c1-2-12-28(13-3-1)44-40-20-9-6-16-32(40)34-25-33-30-15-5-8-18-36(30)42(38(33)26-41(34)44)35-17-7-4-14-29(35)31-22-21-27(24-37(31)42)39-19-10-11-23-43-39/h1-26H
InChIKeyMWHJPFYWNLDNEZ-UHFFFAOYSA-N
MW558.68 g/mol
LogP10.19
Rot. Bonds2

About 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]

5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole] (PubChem CID 90335745) has the molecular formula C42H26N2 and a molecular weight of 558.68 g/mol. Its IUPAC name is 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole].

Molecular Properties

Compound Name5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]
PubChem CID90335745
Molecular FormulaC42H26N2
Molecular Weight558.68 g/mol
Exact Mass558.21
IUPAC Name5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]
SMILESc1ccc(-n2c3ccccc3c3cc4c(cc32)C2(c3ccccc3-c3ccc(-c5ccccn5)cc32)c2ccccc2-4)cc1
InChIInChI=1S/C42H26N2/c1-2-12-28(13-3-1)44-40-20-9-6-16-32(40)34-25-33-30-15-5-8-18-36(30)42(38(33)26-41(34)44)35-17-7-4-14-29(35)31-22-21-27(24-37(31)42)39-19-10-11-23-43-39/h1-26H
InChIKeyMWHJPFYWNLDNEZ-UHFFFAOYSA-N
XLogP10.19
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500558.68
LogP ≤ 510.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5'-phenyl-3'-(9-phenylcarbazol-3-yl)spiro[fluorene-9,7'-indeno[2,1-b]carbazole]
CID 130288956
9-phenyl-2-spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-2-ylcarbazole
CID 134528134
9-(4-pyridin-2-ylphenyl)-3-spiro[14,21-dioxapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaene-10,9'-fluorene]-7-ylcarbazole
CID 129309079
5'-phenyl-2'-(9-phenylcarbazol-1-yl)spiro[fluorene-9,7'-indeno[2,1-b]carbazole]
CID 89472005
9-phenyl-3-[4-[7'-[4-(9-phenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]carbazole
CID 59236537
5,5'-bis(9-phenylcarbazol-2-yl)-7,7'-spirobi[indeno[2,1-b]carbazole]
CID 90337261
N-[3-[2-(9-phenylcarbazol-2-yl)phenyl]-5-pyridin-2-ylphenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 126628034
9-phenyl-2-[3-(9-phenylcarbazol-3-yl)-5-(9,9'-spirobi[fluorene]-2-yl)phenyl]carbazole
CID 140922382
9-[4-[7'-(4-carbazol-9-ylphenyl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]carbazole
CID 59217021
23,37-bis(9-phenylcarbazol-2-yl)spiro[23,37-diazanonacyclo[26.11.0.02,7.08,13.014,26.016,24.017,22.030,38.031,36]nonatriaconta-1(28),2,4,6,8,10,12,14(26),15,17,19,21,24,29,31,33,35,38-octadecaene-27,9'-fluorene]
CID 134555366
5-phenylspiro[indeno[2,1-b]carbazole-7,9'-thioxanthene]
CID 118880676
7-phenyl-5-(9,9'-spirobi[fluorene]-2-yl)indolo[2,3-b]carbazole
CID 122595613

Frequently Asked Questions

What is the IUPAC name of 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]?
The IUPAC name of 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole] (CID 90335745) is 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole].
What is the SMILES notation for 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]?
The canonical SMILES for 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole] is c1ccc(-n2c3ccccc3c3cc4c(cc32)C2(c3ccccc3-c3ccc(-c5ccccn5)cc32)c2ccccc2-4)cc1.
What is the InChIKey of 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]?
The InChIKey is MWHJPFYWNLDNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26N2/c1-2-12-28(13-3-1)44-40-20-9-6-16-32(40)34-25-33-30-15-5-8-18-36(30)42(38(33)26-41(34)44)35-17-7-4-14-29(35)31-22-21-27(24-37(31)42)39-19-10-11-23-43-39/h1-26H.
What are the key properties of 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole]?
5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole] has a molecular weight of 558.68 g/mol, XLogP of 10.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5'-phenyl-2-pyridin-2-ylspiro[fluorene-9,7'-indeno[2,1-b]carbazole] is sourced from PubChem (CID 90335745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).