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

C17H20N6O2 — CID 69282397

IUPAC2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide
SMILESCc1cc(C)n(-c2cc(NC(=O)CN(C)C)nc(-c3ccco3)n2)n1
InChIInChI=1S/C17H20N6O2/c1-11-8-12(2)23(21-11)15-9-14(18-16(24)10-22(3)4)19-17(20-15)13-6-5-7-25-13/h5-9H,10H2,1-4H3,(H,18,19,20,24)
InChIKeyYTOUNVIMXARMEH-UHFFFAOYSA-N
MW340.39 g/mol
LogP2.04
Rot. Bonds5

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

2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide (PubChem CID 69282397) has the molecular formula C17H20N6O2 and a molecular weight of 340.39 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide
PubChem CID69282397
Molecular FormulaC17H20N6O2
Molecular Weight340.39 g/mol
Exact Mass340.16
IUPAC Name2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide
SMILESCc1cc(C)n(-c2cc(NC(=O)CN(C)C)nc(-c3ccco3)n2)n1
InChIInChI=1S/C17H20N6O2/c1-11-8-12(2)23(21-11)15-9-14(18-16(24)10-22(3)4)19-17(20-15)13-6-5-7-25-13/h5-9H,10H2,1-4H3,(H,18,19,20,24)
InChIKeyYTOUNVIMXARMEH-UHFFFAOYSA-N
XLogP2.04
TPSA89.08 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide?
The IUPAC name of 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide (CID 69282397) is 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide is Cc1cc(C)n(-c2cc(NC(=O)CN(C)C)nc(-c3ccco3)n2)n1.
What is the InChIKey of 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide?
The InChIKey is YTOUNVIMXARMEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O2/c1-11-8-12(2)23(21-11)15-9-14(18-16(24)10-22(3)4)19-17(20-15)13-6-5-7-25-13/h5-9H,10H2,1-4H3,(H,18,19,20,24).
What are the key properties of 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide?
2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide has a molecular weight of 340.39 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)pyrimidin-4-yl]acetamide is sourced from PubChem (CID 69282397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).