N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine

C13H10F2N4O — CID 53375182

IUPACN-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESFC(F)Oc1cccc(Nc2n[nH]c3cccnc23)c1
InChIInChI=1S/C13H10F2N4O/c14-13(15)20-9-4-1-3-8(7-9)17-12-11-10(18-19-12)5-2-6-16-11/h1-7,13H,(H2,17,18,19)
InChIKeyHWYYEVMZVBENRT-UHFFFAOYSA-N
MW276.25 g/mol
LogP3.30
Rot. Bonds4

About N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine

N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 53375182) has the molecular formula C13H10F2N4O and a molecular weight of 276.25 g/mol. Its IUPAC name is N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID53375182
Molecular FormulaC13H10F2N4O
Molecular Weight276.25 g/mol
Exact Mass276.08
IUPAC NameN-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESFC(F)Oc1cccc(Nc2n[nH]c3cccnc23)c1
InChIInChI=1S/C13H10F2N4O/c14-13(15)20-9-4-1-3-8(7-9)17-12-11-10(18-19-12)5-2-6-16-11/h1-7,13H,(H2,17,18,19)
InChIKeyHWYYEVMZVBENRT-UHFFFAOYSA-N
XLogP3.30
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.25
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 53375182) is N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine is FC(F)Oc1cccc(Nc2n[nH]c3cccnc23)c1.
What is the InChIKey of N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is HWYYEVMZVBENRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N4O/c14-13(15)20-9-4-1-3-8(7-9)17-12-11-10(18-19-12)5-2-6-16-11/h1-7,13H,(H2,17,18,19).
What are the key properties of N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 276.25 g/mol, XLogP of 3.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(difluoromethoxy)phenyl]-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 53375182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).