N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide

C16H17N7O2 — CID 59251846

IUPACN-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1cn2cc(-c3cnc(N)c(OC4CNC4)n3)ccc2n1
InChIInChI=1S/C16H17N7O2/c1-9(24)20-13-8-23-7-10(2-3-14(23)22-13)12-6-19-15(17)16(21-12)25-11-4-18-5-11/h2-3,6-8,11,18H,4-5H2,1H3,(H2,17,19)(H,20,24)
InChIKeyVLSNPVXWMDASFM-UHFFFAOYSA-N
MW339.36 g/mol
LogP0.68
Rot. Bonds4

About N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide

N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide (PubChem CID 59251846) has the molecular formula C16H17N7O2 and a molecular weight of 339.36 g/mol. Its IUPAC name is N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide
PubChem CID59251846
Molecular FormulaC16H17N7O2
Molecular Weight339.36 g/mol
Exact Mass339.14
IUPAC NameN-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide
SMILESCC(=O)Nc1cn2cc(-c3cnc(N)c(OC4CNC4)n3)ccc2n1
InChIInChI=1S/C16H17N7O2/c1-9(24)20-13-8-23-7-10(2-3-14(23)22-13)12-6-19-15(17)16(21-12)25-11-4-18-5-11/h2-3,6-8,11,18H,4-5H2,1H3,(H2,17,19)(H,20,24)
InChIKeyVLSNPVXWMDASFM-UHFFFAOYSA-N
XLogP0.68
TPSA119.46 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.36
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide?
The IUPAC name of N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide (CID 59251846) is N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide.
What is the SMILES notation for N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide?
The canonical SMILES for N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide is CC(=O)Nc1cn2cc(-c3cnc(N)c(OC4CNC4)n3)ccc2n1.
What is the InChIKey of N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide?
The InChIKey is VLSNPVXWMDASFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N7O2/c1-9(24)20-13-8-23-7-10(2-3-14(23)22-13)12-6-19-15(17)16(21-12)25-11-4-18-5-11/h2-3,6-8,11,18H,4-5H2,1H3,(H2,17,19)(H,20,24).
What are the key properties of N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide?
N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide has a molecular weight of 339.36 g/mol, XLogP of 0.68, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[5-amino-6-(azetidin-3-yloxy)pyrazin-2-yl]imidazo[1,2-a]pyridin-2-yl]acetamide is sourced from PubChem (CID 59251846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).