8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one

C22H24N8O2 — CID 168999368

IUPAC8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one
SMILESCc1cc2ncnn2cc1Nc1ncc2c(n1)c(N1CCOC(C3CC3)C1)cc(=O)n2C
InChIInChI=1S/C22H24N8O2/c1-13-7-19-24-12-25-30(19)10-15(13)26-22-23-9-17-21(27-22)16(8-20(31)28(17)2)29-5-6-32-18(11-29)14-3-4-14/h7-10,12,14,18H,3-6,11H2,1-2H3,(H,23,26,27)
InChIKeyKDGLBZARCKLLAR-UHFFFAOYSA-N
MW432.49 g/mol
LogP2.04
Rot. Bonds4

About 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one

8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one (PubChem CID 168999368) has the molecular formula C22H24N8O2 and a molecular weight of 432.49 g/mol. Its IUPAC name is 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one.

Molecular Properties

Compound Name8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one
PubChem CID168999368
Molecular FormulaC22H24N8O2
Molecular Weight432.49 g/mol
Exact Mass432.20
IUPAC Name8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one
SMILESCc1cc2ncnn2cc1Nc1ncc2c(n1)c(N1CCOC(C3CC3)C1)cc(=O)n2C
InChIInChI=1S/C22H24N8O2/c1-13-7-19-24-12-25-30(19)10-15(13)26-22-23-9-17-21(27-22)16(8-20(31)28(17)2)29-5-6-32-18(11-29)14-3-4-14/h7-10,12,14,18H,3-6,11H2,1-2H3,(H,23,26,27)
InChIKeyKDGLBZARCKLLAR-UHFFFAOYSA-N
XLogP2.04
TPSA102.47 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.49
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Analyze 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one?
The IUPAC name of 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one (CID 168999368) is 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one.
What is the SMILES notation for 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one?
The canonical SMILES for 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one is Cc1cc2ncnn2cc1Nc1ncc2c(n1)c(N1CCOC(C3CC3)C1)cc(=O)n2C.
What is the InChIKey of 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one?
The InChIKey is KDGLBZARCKLLAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N8O2/c1-13-7-19-24-12-25-30(19)10-15(13)26-22-23-9-17-21(27-22)16(8-20(31)28(17)2)29-5-6-32-18(11-29)14-3-4-14/h7-10,12,14,18H,3-6,11H2,1-2H3,(H,23,26,27).
What are the key properties of 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one?
8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one has a molecular weight of 432.49 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-cyclopropylmorpholin-4-yl)-5-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]pyrido[3,2-d]pyrimidin-6-one is sourced from PubChem (CID 168999368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).