N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine

C11H7ClFN5 — CID 53373875

IUPACN-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESFc1ncc(Cl)cc1Nc1n[nH]c2cccnc12
InChIInChI=1S/C11H7ClFN5/c12-6-4-8(10(13)15-5-6)16-11-9-7(17-18-11)2-1-3-14-9/h1-5H,(H2,16,17,18)
InChIKeyGFUKOUBPFRBDFQ-UHFFFAOYSA-N
MW263.66 g/mol
LogP2.89
Rot. Bonds2

About N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine

N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 53373875) has the molecular formula C11H7ClFN5 and a molecular weight of 263.66 g/mol. Its IUPAC name is N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID53373875
Molecular FormulaC11H7ClFN5
Molecular Weight263.66 g/mol
Exact Mass263.04
IUPAC NameN-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESFc1ncc(Cl)cc1Nc1n[nH]c2cccnc12
InChIInChI=1S/C11H7ClFN5/c12-6-4-8(10(13)15-5-6)16-11-9-7(17-18-11)2-1-3-14-9/h1-5H,(H2,16,17,18)
InChIKeyGFUKOUBPFRBDFQ-UHFFFAOYSA-N
XLogP2.89
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.66
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 53373875) is N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine is Fc1ncc(Cl)cc1Nc1n[nH]c2cccnc12.
What is the InChIKey of N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is GFUKOUBPFRBDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClFN5/c12-6-4-8(10(13)15-5-6)16-11-9-7(17-18-11)2-1-3-14-9/h1-5H,(H2,16,17,18).
What are the key properties of N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 263.66 g/mol, XLogP of 2.89, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-fluoro-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 53373875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).