4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide

C20H24N6O — CID 119062826

IUPAC4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide
SMILESCc1cc(-c2ccc(C(=O)N(C)CCn3nc(C)cc3C)cc2)nc(N)n1
InChIInChI=1S/C20H24N6O/c1-13-12-18(23-20(21)22-13)16-5-7-17(8-6-16)19(27)25(4)9-10-26-15(3)11-14(2)24-26/h5-8,11-12H,9-10H2,1-4H3,(H2,21,22,23)
InChIKeyFZRNZGDHVNSKBM-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.62
Rot. Bonds5

About 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide

4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide (PubChem CID 119062826) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide
PubChem CID119062826
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide
SMILESCc1cc(-c2ccc(C(=O)N(C)CCn3nc(C)cc3C)cc2)nc(N)n1
InChIInChI=1S/C20H24N6O/c1-13-12-18(23-20(21)22-13)16-5-7-17(8-6-16)19(27)25(4)9-10-26-15(3)11-14(2)24-26/h5-8,11-12H,9-10H2,1-4H3,(H2,21,22,23)
InChIKeyFZRNZGDHVNSKBM-UHFFFAOYSA-N
XLogP2.62
TPSA89.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide 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 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide?
The IUPAC name of 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide (CID 119062826) is 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide.
What is the SMILES notation for 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide?
The canonical SMILES for 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide is Cc1cc(-c2ccc(C(=O)N(C)CCn3nc(C)cc3C)cc2)nc(N)n1.
What is the InChIKey of 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide?
The InChIKey is FZRNZGDHVNSKBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-13-12-18(23-20(21)22-13)16-5-7-17(8-6-16)19(27)25(4)9-10-26-15(3)11-14(2)24-26/h5-8,11-12H,9-10H2,1-4H3,(H2,21,22,23).
What are the key properties of 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide?
4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide has a molecular weight of 364.45 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-6-methylpyrimidin-4-yl)-N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-N-methylbenzamide is sourced from PubChem (CID 119062826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).