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

C19H17N11 — CID 62706314

IUPAC3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine
SMILESCc1nc(N)nc(-c2c(Nc3ccn[nH]3)nc3ccc(-c4cncnc4C)cn23)n1
InChIInChI=1S/C19H17N11/c1-10-13(7-21-9-22-10)12-3-4-15-27-18(26-14-5-6-23-29-14)16(30(15)8-12)17-24-11(2)25-19(20)28-17/h3-9H,1-2H3,(H2,23,26,29)(H2,20,24,25,28)
InChIKeyFEKALHVHQQPGPI-UHFFFAOYSA-N
MW399.42 g/mol
LogP2.31
Rot. Bonds4

About 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-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-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine (PubChem CID 62706314) has the molecular formula C19H17N11 and a molecular weight of 399.42 g/mol. Its IUPAC name is 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-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-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine
PubChem CID62706314
Molecular FormulaC19H17N11
Molecular Weight399.42 g/mol
Exact Mass399.17
IUPAC Name3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine
SMILESCc1nc(N)nc(-c2c(Nc3ccn[nH]3)nc3ccc(-c4cncnc4C)cn23)n1
InChIInChI=1S/C19H17N11/c1-10-13(7-21-9-22-10)12-3-4-15-27-18(26-14-5-6-23-29-14)16(30(15)8-12)17-24-11(2)25-19(20)28-17/h3-9H,1-2H3,(H2,23,26,29)(H2,20,24,25,28)
InChIKeyFEKALHVHQQPGPI-UHFFFAOYSA-N
XLogP2.31
TPSA148.48 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.42
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

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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-(4-methylpyrimidin-5-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-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine (CID 62706314) is 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-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-(4-methylpyrimidin-5-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-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine is Cc1nc(N)nc(-c2c(Nc3ccn[nH]3)nc3ccc(-c4cncnc4C)cn23)n1.
What is the InChIKey of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine?
The InChIKey is FEKALHVHQQPGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N11/c1-10-13(7-21-9-22-10)12-3-4-15-27-18(26-14-5-6-23-29-14)16(30(15)8-12)17-24-11(2)25-19(20)28-17/h3-9H,1-2H3,(H2,23,26,29)(H2,20,24,25,28).
What are the key properties of 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-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-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine has a molecular weight of 399.42 g/mol, XLogP of 2.31, 4 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-6-(4-methylpyrimidin-5-yl)-N-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 62706314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).