N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide

C25H20N6 — CID 11200537

IUPACN'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide
SMILESN/C(=N\c1ccc2c(c1)Cc1cc(/N=C(\N)c3ccccn3)ccc1-2)c1ccccn1
InChIInChI=1S/C25H20N6/c26-24(22-5-1-3-11-28-22)30-18-7-9-20-16(14-18)13-17-15-19(8-10-21(17)20)31-25(27)23-6-2-4-12-29-23/h1-12,14-15H,13H2,(H2,26,30)(H2,27,31)
InChIKeyHBUUBXCHPTXLDI-UHFFFAOYSA-N
MW404.48 g/mol
LogP4.12
Rot. Bonds4

About N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide

N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide (PubChem CID 11200537) has the molecular formula C25H20N6 and a molecular weight of 404.48 g/mol. Its IUPAC name is N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide.

Molecular Properties

Compound NameN'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide
PubChem CID11200537
Molecular FormulaC25H20N6
Molecular Weight404.48 g/mol
Exact Mass404.17
IUPAC NameN'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide
SMILESN/C(=N\c1ccc2c(c1)Cc1cc(/N=C(\N)c3ccccn3)ccc1-2)c1ccccn1
InChIInChI=1S/C25H20N6/c26-24(22-5-1-3-11-28-22)30-18-7-9-20-16(14-18)13-17-15-19(8-10-21(17)20)31-25(27)23-6-2-4-12-29-23/h1-12,14-15H,13H2,(H2,26,30)(H2,27,31)
InChIKeyHBUUBXCHPTXLDI-UHFFFAOYSA-N
XLogP4.12
TPSA102.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.48
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide?
The IUPAC name of N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide (CID 11200537) is N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide.
What is the SMILES notation for N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide?
The canonical SMILES for N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide is N/C(=N\c1ccc2c(c1)Cc1cc(/N=C(\N)c3ccccn3)ccc1-2)c1ccccn1.
What is the InChIKey of N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide?
The InChIKey is HBUUBXCHPTXLDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N6/c26-24(22-5-1-3-11-28-22)30-18-7-9-20-16(14-18)13-17-15-19(8-10-21(17)20)31-25(27)23-6-2-4-12-29-23/h1-12,14-15H,13H2,(H2,26,30)(H2,27,31).
What are the key properties of N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide?
N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide has a molecular weight of 404.48 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[7-[[amino(pyridin-2-yl)methylidene]amino]-9H-fluoren-2-yl]pyridine-2-carboximidamide is sourced from PubChem (CID 11200537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).