7-ethynyl-9H-fluoren-2-amine

C15H11N — CID 118494896

IUPAC7-ethynyl-9H-fluoren-2-amine
SMILESC#Cc1ccc2c(c1)Cc1cc(N)ccc1-2
InChIInChI=1S/C15H11N/c1-2-10-3-5-14-11(7-10)8-12-9-13(16)4-6-15(12)14/h1,3-7,9H,8,16H2
InChIKeyBUCWMDYYHVIGNA-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.82
Rot. Bonds

About 7-ethynyl-9H-fluoren-2-amine

7-ethynyl-9H-fluoren-2-amine (PubChem CID 118494896) has the molecular formula C15H11N and a molecular weight of 205.26 g/mol. Its IUPAC name is 7-ethynyl-9H-fluoren-2-amine.

Molecular Properties

Compound Name7-ethynyl-9H-fluoren-2-amine
PubChem CID118494896
Molecular FormulaC15H11N
Molecular Weight205.26 g/mol
Exact Mass205.09
IUPAC Name7-ethynyl-9H-fluoren-2-amine
SMILESC#Cc1ccc2c(c1)Cc1cc(N)ccc1-2
InChIInChI=1S/C15H11N/c1-2-10-3-5-14-11(7-10)8-12-9-13(16)4-6-15(12)14/h1,3-7,9H,8,16H2
InChIKeyBUCWMDYYHVIGNA-UHFFFAOYSA-N
XLogP2.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-ethynyl-9H-fluoren-2-amine?
The IUPAC name of 7-ethynyl-9H-fluoren-2-amine (CID 118494896) is 7-ethynyl-9H-fluoren-2-amine.
What is the SMILES notation for 7-ethynyl-9H-fluoren-2-amine?
The canonical SMILES for 7-ethynyl-9H-fluoren-2-amine is C#Cc1ccc2c(c1)Cc1cc(N)ccc1-2.
What is the InChIKey of 7-ethynyl-9H-fluoren-2-amine?
The InChIKey is BUCWMDYYHVIGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N/c1-2-10-3-5-14-11(7-10)8-12-9-13(16)4-6-15(12)14/h1,3-7,9H,8,16H2.
What are the key properties of 7-ethynyl-9H-fluoren-2-amine?
7-ethynyl-9H-fluoren-2-amine has a molecular weight of 205.26 g/mol, XLogP of 2.82, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethynyl-9H-fluoren-2-amine is sourced from PubChem (CID 118494896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).