3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine

C18H18N8O — CID 66789609

IUPAC3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine
SMILESCCOc1ccc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cn1
InChIInChI=1S/C18H18N8O/c1-3-27-14-8-7-12(10-20-14)23-17-15(16-21-11(2)22-18(19)25-16)26-9-5-4-6-13(26)24-17/h4-10,23H,3H2,1-2H3,(H2,19,21,22,25)
InChIKeyGGFHCTGTQGWFGO-UHFFFAOYSA-N
MW362.40 g/mol
LogP2.61
Rot. Bonds5

About 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine

3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine (PubChem CID 66789609) has the molecular formula C18H18N8O and a molecular weight of 362.40 g/mol. Its IUPAC name is 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound Name3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine
PubChem CID66789609
Molecular FormulaC18H18N8O
Molecular Weight362.40 g/mol
Exact Mass362.16
IUPAC Name3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine
SMILESCCOc1ccc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cn1
InChIInChI=1S/C18H18N8O/c1-3-27-14-8-7-12(10-20-14)23-17-15(16-21-11(2)22-18(19)25-16)26-9-5-4-6-13(26)24-17/h4-10,23H,3H2,1-2H3,(H2,19,21,22,25)
InChIKeyGGFHCTGTQGWFGO-UHFFFAOYSA-N
XLogP2.61
TPSA116.14 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine?
The IUPAC name of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine (CID 66789609) is 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine is CCOc1ccc(Nc2nc3ccccn3c2-c2nc(C)nc(N)n2)cn1.
What is the InChIKey of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine?
The InChIKey is GGFHCTGTQGWFGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N8O/c1-3-27-14-8-7-12(10-20-14)23-17-15(16-21-11(2)22-18(19)25-16)26-9-5-4-6-13(26)24-17/h4-10,23H,3H2,1-2H3,(H2,19,21,22,25).
What are the key properties of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine?
3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine has a molecular weight of 362.40 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-N-(6-ethoxy-3-pyridinyl)imidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 66789609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).