5-(3-amino-2-pyridinyl)furan-2-carboxylic acid

C10H8N2O3 — CID 18801341

IUPAC5-(3-amino-2-pyridinyl)furan-2-carboxylic acid
SMILESNc1cccnc1-c1ccc(C(=O)O)o1
InChIInChI=1S/C10H8N2O3/c11-6-2-1-5-12-9(6)7-3-4-8(15-7)10(13)14/h1-5H,11H2,(H,13,14)
InChIKeySHJIZSDQSWTWJN-UHFFFAOYSA-N
MW204.19 g/mol
LogP1.62
Rot. Bonds2

About 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid

5-(3-amino-2-pyridinyl)furan-2-carboxylic acid (PubChem CID 18801341) has the molecular formula C10H8N2O3 and a molecular weight of 204.19 g/mol. Its IUPAC name is 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid.

Molecular Properties

Compound Name5-(3-amino-2-pyridinyl)furan-2-carboxylic acid
PubChem CID18801341
Molecular FormulaC10H8N2O3
Molecular Weight204.19 g/mol
Exact Mass204.05
IUPAC Name5-(3-amino-2-pyridinyl)furan-2-carboxylic acid
SMILESNc1cccnc1-c1ccc(C(=O)O)o1
InChIInChI=1S/C10H8N2O3/c11-6-2-1-5-12-9(6)7-3-4-8(15-7)10(13)14/h1-5H,11H2,(H,13,14)
InChIKeySHJIZSDQSWTWJN-UHFFFAOYSA-N
XLogP1.62
TPSA89.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid?
The IUPAC name of 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid (CID 18801341) is 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid.
What is the SMILES notation for 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid?
The canonical SMILES for 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid is Nc1cccnc1-c1ccc(C(=O)O)o1.
What is the InChIKey of 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid?
The InChIKey is SHJIZSDQSWTWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O3/c11-6-2-1-5-12-9(6)7-3-4-8(15-7)10(13)14/h1-5H,11H2,(H,13,14).
What are the key properties of 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid?
5-(3-amino-2-pyridinyl)furan-2-carboxylic acid has a molecular weight of 204.19 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-amino-2-pyridinyl)furan-2-carboxylic acid is sourced from PubChem (CID 18801341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).