[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine

C28H25N — CID 145110816

IUPAC[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(CN)c4)c3)cc21
InChIInChI=1S/C28H25N/c1-28(2)26-12-4-3-11-24(26)25-14-13-23(17-27(25)28)22-10-6-9-21(16-22)20-8-5-7-19(15-20)18-29/h3-17H,18,29H2,1-2H3
InChIKeySULZAHCQRAISKD-UHFFFAOYSA-N
MW375.52 g/mol
LogP6.79
Rot. Bonds3

About [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine

[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine (PubChem CID 145110816) has the molecular formula C28H25N and a molecular weight of 375.52 g/mol. Its IUPAC name is [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine.

Molecular Properties

Compound Name[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine
PubChem CID145110816
Molecular FormulaC28H25N
Molecular Weight375.52 g/mol
Exact Mass375.20
IUPAC Name[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(CN)c4)c3)cc21
InChIInChI=1S/C28H25N/c1-28(2)26-12-4-3-11-24(26)25-14-13-23(17-27(25)28)22-10-6-9-21(16-22)20-8-5-7-19(15-20)18-29/h3-17H,18,29H2,1-2H3
InChIKeySULZAHCQRAISKD-UHFFFAOYSA-N
XLogP6.79
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.52
LogP ≤ 56.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
CID 140720702
CID 140720702
2-[(9,9-dimethylfluoren-2-yl)methyl]-9,9-dimethyl-7-phenylfluorene
CID 157190437
(E)-4-[7-[7-[7-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]but-3-en-1-amine
CID 143207709
9-(9,9-dimethylfluoren-2-yl)-10-(3-phenylphenyl)anthracene
CID 58782801
2,4-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazine
CID 118530501
6,6,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]indeno[1,2-b]fluorene
CID 140710753
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-[9,9-dimethyl-7-(3-phenylphenyl)fluoren-2-yl]-9,9-dimethylfluorene
CID 58881198
2-[3-(9,9-dimethylfluoren-2-yl)phenyl]chrysene
CID 140710683
2-[6-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]naphthalen-2-yl]-9,9-dimethylfluorene
CID 58351434
2-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 59133445

Frequently Asked Questions

What is the IUPAC name of [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine?
The IUPAC name of [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine (CID 145110816) is [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine.
What is the SMILES notation for [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine?
The canonical SMILES for [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine is CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(CN)c4)c3)cc21.
What is the InChIKey of [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine?
The InChIKey is SULZAHCQRAISKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25N/c1-28(2)26-12-4-3-11-24(26)25-14-13-23(17-27(25)28)22-10-6-9-21(16-22)20-8-5-7-19(15-20)18-29/h3-17H,18,29H2,1-2H3.
What are the key properties of [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine?
[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine has a molecular weight of 375.52 g/mol, XLogP of 6.79, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]methanamine is sourced from PubChem (CID 145110816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).