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

C18H15N9O — CID 66789013

IUPAC3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine
SMILESCc1nc(N)nc(-c2c(Nc3ccn[nH]3)nc3ccc(-c4ccoc4)cn23)n1
InChIInChI=1S/C18H15N9O/c1-10-21-16(25-18(19)22-10)15-17(23-13-4-6-20-26-13)24-14-3-2-11(8-27(14)15)12-5-7-28-9-12/h2-9H,1H3,(H2,20,23,26)(H2,19,21,22,25)
InChIKeyLCGFVSYBPJHRRA-UHFFFAOYSA-N
MW373.38 g/mol
LogP2.80
Rot. Bonds4

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

3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine (PubChem CID 66789013) has the molecular formula C18H15N9O and a molecular weight of 373.38 g/mol. Its IUPAC name is 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound Name3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine
PubChem CID66789013
Molecular FormulaC18H15N9O
Molecular Weight373.38 g/mol
Exact Mass373.14
IUPAC Name3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine
SMILESCc1nc(N)nc(-c2c(Nc3ccn[nH]3)nc3ccc(-c4ccoc4)cn23)n1
InChIInChI=1S/C18H15N9O/c1-10-21-16(25-18(19)22-10)15-17(23-13-4-6-20-26-13)24-14-3-2-11(8-27(14)15)12-5-7-28-9-12/h2-9H,1H3,(H2,20,23,26)(H2,19,21,22,25)
InChIKeyLCGFVSYBPJHRRA-UHFFFAOYSA-N
XLogP2.80
TPSA135.84 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.38
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine?
The IUPAC name of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine (CID 66789013) is 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine is Cc1nc(N)nc(-c2c(Nc3ccn[nH]3)nc3ccc(-c4ccoc4)cn23)n1.
What is the InChIKey of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine?
The InChIKey is LCGFVSYBPJHRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N9O/c1-10-21-16(25-18(19)22-10)15-17(23-13-4-6-20-26-13)24-14-3-2-11(8-27(14)15)12-5-7-28-9-12/h2-9H,1H3,(H2,20,23,26)(H2,19,21,22,25).
What are the key properties of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine?
3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine has a molecular weight of 373.38 g/mol, XLogP of 2.80, 4 rotatable bonds, 3 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)-6-(furan-3-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 66789013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).