2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine

C20H25N7O — CID 25074317

IUPAC2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine
SMILESCOC1CCN(c2cccc(-c3cc(N)nc(-n4nc(C)cc4C)n3)n2)CC1
InChIInChI=1S/C20H25N7O/c1-13-11-14(2)27(25-13)20-23-17(12-18(21)24-20)16-5-4-6-19(22-16)26-9-7-15(28-3)8-10-26/h4-6,11-12,15H,7-10H2,1-3H3,(H2,21,23,24)
InChIKeyAEUINRMFEQDEJQ-UHFFFAOYSA-N
MW379.47 g/mol
LogP2.54
Rot. Bonds4

About 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine

2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine (PubChem CID 25074317) has the molecular formula C20H25N7O and a molecular weight of 379.47 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine
PubChem CID25074317
Molecular FormulaC20H25N7O
Molecular Weight379.47 g/mol
Exact Mass379.21
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine
SMILESCOC1CCN(c2cccc(-c3cc(N)nc(-n4nc(C)cc4C)n3)n2)CC1
InChIInChI=1S/C20H25N7O/c1-13-11-14(2)27(25-13)20-23-17(12-18(21)24-20)16-5-4-6-19(22-16)26-9-7-15(28-3)8-10-26/h4-6,11-12,15H,7-10H2,1-3H3,(H2,21,23,24)
InChIKeyAEUINRMFEQDEJQ-UHFFFAOYSA-N
XLogP2.54
TPSA94.98 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.47
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine 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 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine (CID 25074317) is 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine is COC1CCN(c2cccc(-c3cc(N)nc(-n4nc(C)cc4C)n3)n2)CC1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine?
The InChIKey is AEUINRMFEQDEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N7O/c1-13-11-14(2)27(25-13)20-23-17(12-18(21)24-20)16-5-4-6-19(22-16)26-9-7-15(28-3)8-10-26/h4-6,11-12,15H,7-10H2,1-3H3,(H2,21,23,24).
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine?
2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine has a molecular weight of 379.47 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-amine is sourced from PubChem (CID 25074317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).