9aH-fluorene-1-carboximidamide

C14H12N2 — CID 169034969

IUPAC9aH-fluorene-1-carboximidamide
SMILES[H]/N=C(\N)C1=CC=CC2=c3ccccc3=CC12
InChIInChI=1S/C14H12N2/c15-14(16)12-7-3-6-11-10-5-2-1-4-9(10)8-13(11)12/h1-8,13H,(H3,15,16)
InChIKeyDSNRMZNZLDUJRD-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.68
Rot. Bonds1

About 9aH-fluorene-1-carboximidamide

9aH-fluorene-1-carboximidamide (PubChem CID 169034969) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 9aH-fluorene-1-carboximidamide.

Molecular Properties

Compound Name9aH-fluorene-1-carboximidamide
PubChem CID169034969
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name9aH-fluorene-1-carboximidamide
SMILES[H]/N=C(\N)C1=CC=CC2=c3ccccc3=CC12
InChIInChI=1S/C14H12N2/c15-14(16)12-7-3-6-11-10-5-2-1-4-9(10)8-13(11)12/h1-8,13H,(H3,15,16)
InChIKeyDSNRMZNZLDUJRD-UHFFFAOYSA-N
XLogP0.68
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9aH-fluorene-1-carboximidamide?
The IUPAC name of 9aH-fluorene-1-carboximidamide (CID 169034969) is 9aH-fluorene-1-carboximidamide.
What is the SMILES notation for 9aH-fluorene-1-carboximidamide?
The canonical SMILES for 9aH-fluorene-1-carboximidamide is [H]/N=C(\N)C1=CC=CC2=c3ccccc3=CC12.
What is the InChIKey of 9aH-fluorene-1-carboximidamide?
The InChIKey is DSNRMZNZLDUJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2/c15-14(16)12-7-3-6-11-10-5-2-1-4-9(10)8-13(11)12/h1-8,13H,(H3,15,16).
What are the key properties of 9aH-fluorene-1-carboximidamide?
9aH-fluorene-1-carboximidamide has a molecular weight of 208.26 g/mol, XLogP of 0.68, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9aH-fluorene-1-carboximidamide is sourced from PubChem (CID 169034969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).