5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one

C24H25N7O2 — CID 86267615

IUPAC5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one
SMILESCc1nc(-c2cnc(N3CCCCC3)[nH]c2=O)ccc1Oc1ccnc(-c2cnn(C)c2)c1
InChIInChI=1S/C24H25N7O2/c1-16-22(33-18-8-9-25-21(12-18)17-13-27-30(2)15-17)7-6-20(28-16)19-14-26-24(29-23(19)32)31-10-4-3-5-11-31/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,26,29,32)
InChIKeyUHWRZSFKINYFKS-UHFFFAOYSA-N
MW443.51 g/mol
LogP3.72
Rot. Bonds5

About 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one

5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one (PubChem CID 86267615) has the molecular formula C24H25N7O2 and a molecular weight of 443.51 g/mol. Its IUPAC name is 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one
PubChem CID86267615
Molecular FormulaC24H25N7O2
Molecular Weight443.51 g/mol
Exact Mass443.21
IUPAC Name5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one
SMILESCc1nc(-c2cnc(N3CCCCC3)[nH]c2=O)ccc1Oc1ccnc(-c2cnn(C)c2)c1
InChIInChI=1S/C24H25N7O2/c1-16-22(33-18-8-9-25-21(12-18)17-13-27-30(2)15-17)7-6-20(28-16)19-14-26-24(29-23(19)32)31-10-4-3-5-11-31/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,26,29,32)
InChIKeyUHWRZSFKINYFKS-UHFFFAOYSA-N
XLogP3.72
TPSA101.82 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.51
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one?
The IUPAC name of 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one (CID 86267615) is 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one?
The canonical SMILES for 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one is Cc1nc(-c2cnc(N3CCCCC3)[nH]c2=O)ccc1Oc1ccnc(-c2cnn(C)c2)c1.
What is the InChIKey of 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one?
The InChIKey is UHWRZSFKINYFKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N7O2/c1-16-22(33-18-8-9-25-21(12-18)17-13-27-30(2)15-17)7-6-20(28-16)19-14-26-24(29-23(19)32)31-10-4-3-5-11-31/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,26,29,32).
What are the key properties of 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one?
5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one has a molecular weight of 443.51 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-methyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]-2-pyridinyl]-2-piperidin-1-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 86267615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).