N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine

C16H12FN5O — CID 71246917

IUPACN-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine
SMILESFc1ccccc1Cn1ncc2cnc(Nc3ncco3)cc21
InChIInChI=1S/C16H12FN5O/c17-13-4-2-1-3-11(13)10-22-14-7-15(19-8-12(14)9-20-22)21-16-18-5-6-23-16/h1-9H,10H2,(H,18,19,21)
InChIKeyPZOUCTGPIGIIJB-UHFFFAOYSA-N
MW309.30 g/mol
LogP3.35
Rot. Bonds4

About N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine

N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine (PubChem CID 71246917) has the molecular formula C16H12FN5O and a molecular weight of 309.30 g/mol. Its IUPAC name is N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine
PubChem CID71246917
Molecular FormulaC16H12FN5O
Molecular Weight309.30 g/mol
Exact Mass309.10
IUPAC NameN-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine
SMILESFc1ccccc1Cn1ncc2cnc(Nc3ncco3)cc21
InChIInChI=1S/C16H12FN5O/c17-13-4-2-1-3-11(13)10-22-14-7-15(19-8-12(14)9-20-22)21-16-18-5-6-23-16/h1-9H,10H2,(H,18,19,21)
InChIKeyPZOUCTGPIGIIJB-UHFFFAOYSA-N
XLogP3.35
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.30
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine?
The IUPAC name of N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine (CID 71246917) is N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine.
What is the SMILES notation for N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine?
The canonical SMILES for N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine is Fc1ccccc1Cn1ncc2cnc(Nc3ncco3)cc21.
What is the InChIKey of N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine?
The InChIKey is PZOUCTGPIGIIJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN5O/c17-13-4-2-1-3-11(13)10-22-14-7-15(19-8-12(14)9-20-22)21-16-18-5-6-23-16/h1-9H,10H2,(H,18,19,21).
What are the key properties of N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine?
N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine has a molecular weight of 309.30 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2-fluorophenyl)methyl]pyrazolo[4,3-c]pyridin-6-yl]-1,3-oxazol-2-amine is sourced from PubChem (CID 71246917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).