2-bromo-N,N-dimethyl-9H-fluoren-9-amine

C15H14BrN — CID 54194924

IUPAC2-bromo-N,N-dimethyl-9H-fluoren-9-amine
SMILESCN(C)C1c2ccccc2-c2ccc(Br)cc21
InChIInChI=1S/C15H14BrN/c1-17(2)15-13-6-4-3-5-11(13)12-8-7-10(16)9-14(12)15/h3-9,15H,1-2H3
InChIKeyPLCWVWTZAXAVCH-UHFFFAOYSA-N
MW288.19 g/mol
LogP4.08
Rot. Bonds1

About 2-bromo-N,N-dimethyl-9H-fluoren-9-amine

2-bromo-N,N-dimethyl-9H-fluoren-9-amine (PubChem CID 54194924) has the molecular formula C15H14BrN and a molecular weight of 288.19 g/mol. Its IUPAC name is 2-bromo-N,N-dimethyl-9H-fluoren-9-amine.

Molecular Properties

Compound Name2-bromo-N,N-dimethyl-9H-fluoren-9-amine
PubChem CID54194924
Molecular FormulaC15H14BrN
Molecular Weight288.19 g/mol
Exact Mass287.03
IUPAC Name2-bromo-N,N-dimethyl-9H-fluoren-9-amine
SMILESCN(C)C1c2ccccc2-c2ccc(Br)cc21
InChIInChI=1S/C15H14BrN/c1-17(2)15-13-6-4-3-5-11(13)12-8-7-10(16)9-14(12)15/h3-9,15H,1-2H3
InChIKeyPLCWVWTZAXAVCH-UHFFFAOYSA-N
XLogP4.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.19
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-N,N-dimethyl-9H-fluoren-9-amine?
The IUPAC name of 2-bromo-N,N-dimethyl-9H-fluoren-9-amine (CID 54194924) is 2-bromo-N,N-dimethyl-9H-fluoren-9-amine.
What is the SMILES notation for 2-bromo-N,N-dimethyl-9H-fluoren-9-amine?
The canonical SMILES for 2-bromo-N,N-dimethyl-9H-fluoren-9-amine is CN(C)C1c2ccccc2-c2ccc(Br)cc21.
What is the InChIKey of 2-bromo-N,N-dimethyl-9H-fluoren-9-amine?
The InChIKey is PLCWVWTZAXAVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN/c1-17(2)15-13-6-4-3-5-11(13)12-8-7-10(16)9-14(12)15/h3-9,15H,1-2H3.
What are the key properties of 2-bromo-N,N-dimethyl-9H-fluoren-9-amine?
2-bromo-N,N-dimethyl-9H-fluoren-9-amine has a molecular weight of 288.19 g/mol, XLogP of 4.08, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N,N-dimethyl-9H-fluoren-9-amine is sourced from PubChem (CID 54194924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).