N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide

C21H25N7O2 — CID 25138092

IUPACN-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide
SMILESCC(=O)Nc1cc(-c2cccc(N3CCC(O)CC3)n2)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C21H25N7O2/c1-13-11-14(2)28(26-13)21-24-18(12-19(25-21)22-15(3)29)17-5-4-6-20(23-17)27-9-7-16(30)8-10-27/h4-6,11-12,16,30H,7-10H2,1-3H3,(H,22,24,25,29)
InChIKeyNOMOVVSYFDZGOW-UHFFFAOYSA-N
MW407.48 g/mol
LogP2.26
Rot. Bonds4

About N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide

N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide (PubChem CID 25138092) has the molecular formula C21H25N7O2 and a molecular weight of 407.48 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide
PubChem CID25138092
Molecular FormulaC21H25N7O2
Molecular Weight407.48 g/mol
Exact Mass407.21
IUPAC NameN-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide
SMILESCC(=O)Nc1cc(-c2cccc(N3CCC(O)CC3)n2)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C21H25N7O2/c1-13-11-14(2)28(26-13)21-24-18(12-19(25-21)22-15(3)29)17-5-4-6-20(23-17)27-9-7-16(30)8-10-27/h4-6,11-12,16,30H,7-10H2,1-3H3,(H,22,24,25,29)
InChIKeyNOMOVVSYFDZGOW-UHFFFAOYSA-N
XLogP2.26
TPSA109.06 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.48
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide 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 N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide?
The IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide (CID 25138092) is N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide.
What is the SMILES notation for N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide?
The canonical SMILES for N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide is CC(=O)Nc1cc(-c2cccc(N3CCC(O)CC3)n2)nc(-n2nc(C)cc2C)n1.
What is the InChIKey of N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide?
The InChIKey is NOMOVVSYFDZGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N7O2/c1-13-11-14(2)28(26-13)21-24-18(12-19(25-21)22-15(3)29)17-5-4-6-20(23-17)27-9-7-16(30)8-10-27/h4-6,11-12,16,30H,7-10H2,1-3H3,(H,22,24,25,29).
What are the key properties of N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide?
N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide has a molecular weight of 407.48 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-hydroxypiperidin-1-yl)-2-pyridinyl]pyrimidin-4-yl]acetamide is sourced from PubChem (CID 25138092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).