2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine

C11H15N5 — CID 657722

IUPAC2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine
SMILESCNc1cc(C)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C11H15N5/c1-7-6-10(12-4)14-11(13-7)16-9(3)5-8(2)15-16/h5-6H,1-4H3,(H,12,13,14)
InChIKeyGIAYWMGCMGIWGE-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.63
Rot. Bonds2

About 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine

2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine (PubChem CID 657722) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine
PubChem CID657722
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine
SMILESCNc1cc(C)nc(-n2nc(C)cc2C)n1
InChIInChI=1S/C11H15N5/c1-7-6-10(12-4)14-11(13-7)16-9(3)5-8(2)15-16/h5-6H,1-4H3,(H,12,13,14)
InChIKeyGIAYWMGCMGIWGE-UHFFFAOYSA-N
XLogP1.63
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine (CID 657722) is 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine is CNc1cc(C)nc(-n2nc(C)cc2C)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine?
The InChIKey is GIAYWMGCMGIWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-7-6-10(12-4)14-11(13-7)16-9(3)5-8(2)15-16/h5-6H,1-4H3,(H,12,13,14).
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine?
2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine has a molecular weight of 217.28 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-N,6-dimethylpyrimidin-4-amine is sourced from PubChem (CID 657722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).