9H-fluoren-1-amine

C13H11N — CID 22817

IUPAC9H-fluoren-1-amine
SMILESNc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C13H11N/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-7H,8,14H2
InChIKeyCYSPWCARDHRYJX-UHFFFAOYSA-N
MW181.24 g/mol
LogP2.84
Rot. Bonds

About 9H-fluoren-1-amine

9H-fluoren-1-amine (PubChem CID 22817) has the molecular formula C13H11N and a molecular weight of 181.24 g/mol. Its IUPAC name is 9H-fluoren-1-amine.

Molecular Properties

Compound Name9H-fluoren-1-amine
PubChem CID22817
Molecular FormulaC13H11N
Molecular Weight181.24 g/mol
Exact Mass181.09
IUPAC Name9H-fluoren-1-amine
SMILESNc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C13H11N/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-7H,8,14H2
InChIKeyCYSPWCARDHRYJX-UHFFFAOYSA-N
XLogP2.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-1-amine?
The IUPAC name of 9H-fluoren-1-amine (CID 22817) is 9H-fluoren-1-amine.
What is the SMILES notation for 9H-fluoren-1-amine?
The canonical SMILES for 9H-fluoren-1-amine is Nc1cccc2c1Cc1ccccc1-2.
What is the InChIKey of 9H-fluoren-1-amine?
The InChIKey is CYSPWCARDHRYJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-7H,8,14H2.
What are the key properties of 9H-fluoren-1-amine?
9H-fluoren-1-amine has a molecular weight of 181.24 g/mol, XLogP of 2.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-1-amine is sourced from PubChem (CID 22817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).