3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole

C30H22N2 — CID 139526334

IUPAC3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole
SMILESc1ccc2c(c1)Cc1cc(C(c3c[nH]c4ccccc34)c3c[nH]c4ccccc34)ccc1-2
InChIInChI=1S/C30H22N2/c1-2-8-22-19(7-1)15-21-16-20(13-14-23(21)22)30(26-17-31-28-11-5-3-9-24(26)28)27-18-32-29-12-6-4-10-25(27)29/h1-14,16-18,30-32H,15H2
InChIKeyRJZCCKLOQQKPFN-UHFFFAOYSA-N
MW410.52 g/mol
LogP7.40
Rot. Bonds3

About 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole

3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole (PubChem CID 139526334) has the molecular formula C30H22N2 and a molecular weight of 410.52 g/mol. Its IUPAC name is 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole.

Molecular Properties

Compound Name3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole
PubChem CID139526334
Molecular FormulaC30H22N2
Molecular Weight410.52 g/mol
Exact Mass410.18
IUPAC Name3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole
SMILESc1ccc2c(c1)Cc1cc(C(c3c[nH]c4ccccc34)c3c[nH]c4ccccc34)ccc1-2
InChIInChI=1S/C30H22N2/c1-2-8-22-19(7-1)15-21-16-20(13-14-23(21)22)30(26-17-31-28-11-5-3-9-24(26)28)27-18-32-29-12-6-4-10-25(27)29/h1-14,16-18,30-32H,15H2
InChIKeyRJZCCKLOQQKPFN-UHFFFAOYSA-N
XLogP7.40
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.52
LogP ≤ 57.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Related Compounds

3-[3H-inden-1-yl(1H-indol-3-yl)methyl]-1H-indole
CID 157471669
4-[3H-inden-1-yl(1H-indol-3-yl)methyl]benzaldehyde
CID 159608053
3-[1H-imidazol-2-yl(3H-inden-1-yl)methyl]-1H-indole
CID 163911567
3-[1H-indol-3-yl(phenyl)methyl]-5-methyl-1H-indole
CID 25098654
4-[(3,4-dichlorophenyl)-(1H-indol-3-yl)methyl]aniline
CID 134960687
2-[(3-bromophenyl)-(1H-indol-3-yl)methyl]phenol
CID 172711246
3-[bis(4-methoxyphenyl)methyl]-1H-indole
CID 4102319
2-[4-[bis(1H-indol-3-yl)methyl]-2-ethoxyphenoxy]acetic acid
CID 2907269
5-bromo-2-[3H-inden-1-yl(1H-indol-3-yl)methyl]phenol
CID 163425608
2-amino-1-(9H-fluoren-2-yl)ethanol
CID 14023206
2-(1-bromopropan-2-yl)-9H-fluorene
CID 66469849
2-[4-(9H-fluoren-2-yl)-3-methylidenepentan-2-yl]-9H-fluorene
CID 123999065

Frequently Asked Questions

What is the IUPAC name of 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole?
The IUPAC name of 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole (CID 139526334) is 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole.
What is the SMILES notation for 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole?
The canonical SMILES for 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole is c1ccc2c(c1)Cc1cc(C(c3c[nH]c4ccccc34)c3c[nH]c4ccccc34)ccc1-2.
What is the InChIKey of 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole?
The InChIKey is RJZCCKLOQQKPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N2/c1-2-8-22-19(7-1)15-21-16-20(13-14-23(21)22)30(26-17-31-28-11-5-3-9-24(26)28)27-18-32-29-12-6-4-10-25(27)29/h1-14,16-18,30-32H,15H2.
What are the key properties of 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole?
3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole has a molecular weight of 410.52 g/mol, XLogP of 7.40, 3 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9H-fluoren-2-yl(1H-indol-3-yl)methyl]-1H-indole is sourced from PubChem (CID 139526334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).