2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid

C14H11N3O2 — CID 175148689

IUPAC2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid
SMILESNc1nccc(C2=CCc3ncccc32)c1C(=O)O
InChIInChI=1S/C14H11N3O2/c15-13-12(14(18)19)10(5-7-17-13)8-3-4-11-9(8)2-1-6-16-11/h1-3,5-7H,4H2,(H2,15,17)(H,18,19)
InChIKeyDLKXIVIFCDRQCA-UHFFFAOYSA-N
MW253.26 g/mol
LogP1.74
Rot. Bonds2

About 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid

2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid (PubChem CID 175148689) has the molecular formula C14H11N3O2 and a molecular weight of 253.26 g/mol. Its IUPAC name is 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid
PubChem CID175148689
Molecular FormulaC14H11N3O2
Molecular Weight253.26 g/mol
Exact Mass253.09
IUPAC Name2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid
SMILESNc1nccc(C2=CCc3ncccc32)c1C(=O)O
InChIInChI=1S/C14H11N3O2/c15-13-12(14(18)19)10(5-7-17-13)8-3-4-11-9(8)2-1-6-16-11/h1-3,5-7H,4H2,(H2,15,17)(H,18,19)
InChIKeyDLKXIVIFCDRQCA-UHFFFAOYSA-N
XLogP1.74
TPSA89.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid?
The IUPAC name of 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid (CID 175148689) is 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid is Nc1nccc(C2=CCc3ncccc32)c1C(=O)O.
What is the InChIKey of 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid?
The InChIKey is DLKXIVIFCDRQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2/c15-13-12(14(18)19)10(5-7-17-13)8-3-4-11-9(8)2-1-6-16-11/h1-3,5-7H,4H2,(H2,15,17)(H,18,19).
What are the key properties of 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid?
2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid has a molecular weight of 253.26 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(7H-cyclopenta[b]pyridin-5-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 175148689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).