5-methoxy-9H-fluoren-1-amine

C14H13NO — CID 21317754

IUPAC5-methoxy-9H-fluoren-1-amine
SMILESCOc1cccc2c1-c1cccc(N)c1C2
InChIInChI=1S/C14H13NO/c1-16-13-7-2-4-9-8-11-10(14(9)13)5-3-6-12(11)15/h2-7H,8,15H2,1H3
InChIKeyLJWTZLBTOXBGSA-UHFFFAOYSA-N
MW211.26 g/mol
LogP2.85
Rot. Bonds1

About 5-methoxy-9H-fluoren-1-amine

5-methoxy-9H-fluoren-1-amine (PubChem CID 21317754) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is 5-methoxy-9H-fluoren-1-amine.

Molecular Properties

Compound Name5-methoxy-9H-fluoren-1-amine
PubChem CID21317754
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC Name5-methoxy-9H-fluoren-1-amine
SMILESCOc1cccc2c1-c1cccc(N)c1C2
InChIInChI=1S/C14H13NO/c1-16-13-7-2-4-9-8-11-10(14(9)13)5-3-6-12(11)15/h2-7H,8,15H2,1H3
InChIKeyLJWTZLBTOXBGSA-UHFFFAOYSA-N
XLogP2.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-9H-fluoren-1-amine?
The IUPAC name of 5-methoxy-9H-fluoren-1-amine (CID 21317754) is 5-methoxy-9H-fluoren-1-amine.
What is the SMILES notation for 5-methoxy-9H-fluoren-1-amine?
The canonical SMILES for 5-methoxy-9H-fluoren-1-amine is COc1cccc2c1-c1cccc(N)c1C2.
What is the InChIKey of 5-methoxy-9H-fluoren-1-amine?
The InChIKey is LJWTZLBTOXBGSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO/c1-16-13-7-2-4-9-8-11-10(14(9)13)5-3-6-12(11)15/h2-7H,8,15H2,1H3.
What are the key properties of 5-methoxy-9H-fluoren-1-amine?
5-methoxy-9H-fluoren-1-amine has a molecular weight of 211.26 g/mol, XLogP of 2.85, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-9H-fluoren-1-amine is sourced from PubChem (CID 21317754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).