3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]

C38H25N — CID 90253720

IUPAC3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]
SMILESCc1ccc2c(c1)c1ccc3c(c1n2-c1ccccc1)-c1ccccc1C31c2ccccc2-c2ccccc21
InChIInChI=1S/C38H25N/c1-24-19-22-35-30(23-24)28-20-21-34-36(37(28)39(35)25-11-3-2-4-12-25)29-15-7-10-18-33(29)38(34)31-16-8-5-13-26(31)27-14-6-9-17-32(27)38/h2-23H,1H3
InChIKeyQFQNAYPLVMBHEH-UHFFFAOYSA-N
MW495.63 g/mol
LogP9.44
Rot. Bonds1

About 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]

3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole] (PubChem CID 90253720) has the molecular formula C38H25N and a molecular weight of 495.63 g/mol. Its IUPAC name is 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole].

Molecular Properties

Compound Name3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]
PubChem CID90253720
Molecular FormulaC38H25N
Molecular Weight495.63 g/mol
Exact Mass495.20
IUPAC Name3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]
SMILESCc1ccc2c(c1)c1ccc3c(c1n2-c1ccccc1)-c1ccccc1C31c2ccccc2-c2ccccc21
InChIInChI=1S/C38H25N/c1-24-19-22-35-30(23-24)28-20-21-34-36(37(28)39(35)25-11-3-2-4-12-25)29-15-7-10-18-33(29)38(34)31-16-8-5-13-26(31)27-14-6-9-17-32(27)38/h2-23H,1H3
InChIKeyQFQNAYPLVMBHEH-UHFFFAOYSA-N
XLogP9.44
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500495.63
LogP ≤ 59.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

12'-phenyl-3'-(12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]-3'-yl)spiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 90253707
5,15-diphenylspiro[5,15-diazaheptacyclo[14.11.0.02,14.04,12.06,11.017,25.018,23]heptacosa-1(16),2(14),3,6,8,10,12,17(25),18,20,22,26-dodecaene-24,9'-xanthene]
CID 118614743
CID 134551739
CID 134551739
11,11-dimethyl-15-phenylspiro[15-azaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.018,23]heptacosa-1(16),2,4(12),5,7,9,13,17(25),18,20,22,26-dodecaene-24,9'-xanthene]
CID 118614896
12'-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 90247208
3-methyl-9-naphthalen-2-ylcarbazole;3-methyl-9-phenylcarbazole;4'-methyl-9,9'-spirobi[fluorene]
CID 145345825
3-phenyl-12-[4-(3-phenylcarbazol-9-yl)phenyl]spiro[indeno[1,2-a]carbazole-7,9'-xanthene]
CID 118614731
12'-[4-[4-(3-carbazol-9-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]spiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 169014741
7,7-diphenyl-12-(3-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]indeno[1,2-a]carbazole
CID 121343577
3'-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 154602219
12'-[4-[3-(3,5-diphenylphenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]-3'-(9-phenylcarbazol-3-yl)spiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 118613483
12'-dibenzofuran-2-ylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]
CID 90253710

Frequently Asked Questions

What is the IUPAC name of 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]?
The IUPAC name of 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole] (CID 90253720) is 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole].
What is the SMILES notation for 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]?
The canonical SMILES for 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole] is Cc1ccc2c(c1)c1ccc3c(c1n2-c1ccccc1)-c1ccccc1C31c2ccccc2-c2ccccc21.
What is the InChIKey of 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]?
The InChIKey is QFQNAYPLVMBHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25N/c1-24-19-22-35-30(23-24)28-20-21-34-36(37(28)39(35)25-11-3-2-4-12-25)29-15-7-10-18-33(29)38(34)31-16-8-5-13-26(31)27-14-6-9-17-32(27)38/h2-23H,1H3.
What are the key properties of 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole]?
3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole] has a molecular weight of 495.63 g/mol, XLogP of 9.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-methyl-12'-phenylspiro[fluorene-9,7'-indeno[1,2-a]carbazole] is sourced from PubChem (CID 90253720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).