N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine

C23H21N — CID 144645565

IUPACN-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine
SMILESC=Nc1ccccc1Cc1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H21N/c1-23(2)20-10-6-5-9-18(20)19-13-12-16(15-21(19)23)14-17-8-4-7-11-22(17)24-3/h4-13,15H,3,14H2,1-2H3
InChIKeyGJGRWSHIGWXRJT-UHFFFAOYSA-N
MW311.43 g/mol
LogP5.92
Rot. Bonds3

About N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine

N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine (PubChem CID 144645565) has the molecular formula C23H21N and a molecular weight of 311.43 g/mol. Its IUPAC name is N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine.

Molecular Properties

Compound NameN-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine
PubChem CID144645565
Molecular FormulaC23H21N
Molecular Weight311.43 g/mol
Exact Mass311.17
IUPAC NameN-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine
SMILESC=Nc1ccccc1Cc1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H21N/c1-23(2)20-10-6-5-9-18(20)19-13-12-16(15-21(19)23)14-17-8-4-7-11-22(17)24-3/h4-13,15H,3,14H2,1-2H3
InChIKeyGJGRWSHIGWXRJT-UHFFFAOYSA-N
XLogP5.92
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.43
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-[(9,9-dimethylfluoren-2-yl)methyl]-9,9-dimethyl-7-phenylfluorene
CID 157190437
2-[(9,9-dimethylfluoren-2-yl)methyl]-9,9-dimethylfluorene;4-(2-ethenylphenyl)-9,9-dimethylfluorene
CID 142604738
2'-ethyl-9,9-dimethylspiro[anthracene-10,9'-fluorene]
CID 142481262
9,9-dimethyl-1-[(4-phenylphenyl)methyl]fluorene
CID 144558289
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
9,9-dimethylfluoren-2-amine;sulfane
CID 142283327
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
9,9-dimethyl-2-(2-methylphenyl)fluorene
CID 58389997
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
ethane;methane;2,9,9-trimethylfluorene
CID 144920604
4-[4-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]-N-methyl-N,2-diphenylaniline
CID 144810304
2-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 59133445

Frequently Asked Questions

What is the IUPAC name of N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine?
The IUPAC name of N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine (CID 144645565) is N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine.
What is the SMILES notation for N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine?
The canonical SMILES for N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine is C=Nc1ccccc1Cc1ccc2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine?
The InChIKey is GJGRWSHIGWXRJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N/c1-23(2)20-10-6-5-9-18(20)19-13-12-16(15-21(19)23)14-17-8-4-7-11-22(17)24-3/h4-13,15H,3,14H2,1-2H3.
What are the key properties of N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine?
N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine has a molecular weight of 311.43 g/mol, XLogP of 5.92, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(9,9-dimethylfluoren-2-yl)methyl]phenyl]methanimine is sourced from PubChem (CID 144645565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).