2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide

C12H15N5O — CID 107337477

IUPAC2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)Cc2ccc(N)cn2)n(C)n1
InChIInChI=1S/C12H15N5O/c1-8-5-11(17(2)16-8)15-12(18)6-10-4-3-9(13)7-14-10/h3-5,7H,6,13H2,1-2H3,(H,15,18)
InChIKeyYGROIXSLCGHTFT-UHFFFAOYSA-N
MW245.29 g/mol
LogP0.89
Rot. Bonds3

About 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide

2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide (PubChem CID 107337477) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
PubChem CID107337477
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)Cc2ccc(N)cn2)n(C)n1
InChIInChI=1S/C12H15N5O/c1-8-5-11(17(2)16-8)15-12(18)6-10-4-3-9(13)7-14-10/h3-5,7H,6,13H2,1-2H3,(H,15,18)
InChIKeyYGROIXSLCGHTFT-UHFFFAOYSA-N
XLogP0.89
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide (CID 107337477) is 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide is Cc1cc(NC(=O)Cc2ccc(N)cn2)n(C)n1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The InChIKey is YGROIXSLCGHTFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-8-5-11(17(2)16-8)15-12(18)6-10-4-3-9(13)7-14-10/h3-5,7H,6,13H2,1-2H3,(H,15,18).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide has a molecular weight of 245.29 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide is sourced from PubChem (CID 107337477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).