6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide

C16H14N6O — CID 10870488

IUPAC6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(-c2ccc(-c3ccc(/C(N)=N/[H])cn3)o2)nc1
InChIInChI=1S/C16H14N6O/c17-15(18)9-1-3-11(21-7-9)13-5-6-14(23-13)12-4-2-10(8-22-12)16(19)20/h1-8H,(H3,17,18)(H3,19,20)
InChIKeyYIOIBLVIGXIOMG-UHFFFAOYSA-N
MW306.33 g/mol
LogP1.97
Rot. Bonds4

About 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide

6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide (PubChem CID 10870488) has the molecular formula C16H14N6O and a molecular weight of 306.33 g/mol. Its IUPAC name is 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide.

Molecular Properties

Compound Name6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide
PubChem CID10870488
Molecular FormulaC16H14N6O
Molecular Weight306.33 g/mol
Exact Mass306.12
IUPAC Name6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(-c2ccc(-c3ccc(/C(N)=N/[H])cn3)o2)nc1
InChIInChI=1S/C16H14N6O/c17-15(18)9-1-3-11(21-7-9)13-5-6-14(23-13)12-4-2-10(8-22-12)16(19)20/h1-8H,(H3,17,18)(H3,19,20)
InChIKeyYIOIBLVIGXIOMG-UHFFFAOYSA-N
XLogP1.97
TPSA138.66 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.33
LogP ≤ 51.97
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide?
The IUPAC name of 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide (CID 10870488) is 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide.
What is the SMILES notation for 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide?
The canonical SMILES for 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(-c2ccc(-c3ccc(/C(N)=N/[H])cn3)o2)nc1.
What is the InChIKey of 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide?
The InChIKey is YIOIBLVIGXIOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N6O/c17-15(18)9-1-3-11(21-7-9)13-5-6-14(23-13)12-4-2-10(8-22-12)16(19)20/h1-8H,(H3,17,18)(H3,19,20).
What are the key properties of 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide?
6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide has a molecular weight of 306.33 g/mol, XLogP of 1.97, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(5-carbamimidoyl-2-pyridinyl)furan-2-yl]pyridine-3-carboximidamide is sourced from PubChem (CID 10870488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).