N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide

C16H12FN5O2 — CID 71003771

IUPACN-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1cc2ccc(-c3cc(F)c4oc(N)nc4c3)cn2n1
InChIInChI=1S/C16H12FN5O2/c1-8(23)19-14-6-11-3-2-9(7-22(11)21-14)10-4-12(17)15-13(5-10)20-16(18)24-15/h2-7H,1H3,(H2,18,20)(H,19,21,23)
InChIKeyKONXNAYFZKJVHC-UHFFFAOYSA-N
MW325.30 g/mol
LogP2.82
Rot. Bonds2

About N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide

N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide (PubChem CID 71003771) has the molecular formula C16H12FN5O2 and a molecular weight of 325.30 g/mol. Its IUPAC name is N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide
PubChem CID71003771
Molecular FormulaC16H12FN5O2
Molecular Weight325.30 g/mol
Exact Mass325.10
IUPAC NameN-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1cc2ccc(-c3cc(F)c4oc(N)nc4c3)cn2n1
InChIInChI=1S/C16H12FN5O2/c1-8(23)19-14-6-11-3-2-9(7-22(11)21-14)10-4-12(17)15-13(5-10)20-16(18)24-15/h2-7H,1H3,(H2,18,20)(H,19,21,23)
InChIKeyKONXNAYFZKJVHC-UHFFFAOYSA-N
XLogP2.82
TPSA98.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.30
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide?
The IUPAC name of N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide (CID 71003771) is N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide.
What is the SMILES notation for N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide?
The canonical SMILES for N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide is CC(=O)Nc1cc2ccc(-c3cc(F)c4oc(N)nc4c3)cn2n1.
What is the InChIKey of N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide?
The InChIKey is KONXNAYFZKJVHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN5O2/c1-8(23)19-14-6-11-3-2-9(7-22(11)21-14)10-4-12(17)15-13(5-10)20-16(18)24-15/h2-7H,1H3,(H2,18,20)(H,19,21,23).
What are the key properties of N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide?
N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide has a molecular weight of 325.30 g/mol, XLogP of 2.82, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-amino-7-fluoro-1,3-benzoxazol-5-yl)pyrazolo[1,5-a]pyridin-2-yl]acetamide is sourced from PubChem (CID 71003771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).