2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide

C15H23N5O — CID 43573838

IUPAC2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide
SMILESCc1cc2ncc(C(C)NC(C)C(=O)N(C)C)c(C)n2n1
InChIInChI=1S/C15H23N5O/c1-9-7-14-16-8-13(12(4)20(14)18-9)10(2)17-11(3)15(21)19(5)6/h7-8,10-11,17H,1-6H3
InChIKeyZQZTWDWSTVJISR-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.47
Rot. Bonds4

About 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide

2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide (PubChem CID 43573838) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide
PubChem CID43573838
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide
SMILESCc1cc2ncc(C(C)NC(C)C(=O)N(C)C)c(C)n2n1
InChIInChI=1S/C15H23N5O/c1-9-7-14-16-8-13(12(4)20(14)18-9)10(2)17-11(3)15(21)19(5)6/h7-8,10-11,17H,1-6H3
InChIKeyZQZTWDWSTVJISR-UHFFFAOYSA-N
XLogP1.47
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide (CID 43573838) is 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide is Cc1cc2ncc(C(C)NC(C)C(=O)N(C)C)c(C)n2n1.
What is the InChIKey of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide?
The InChIKey is ZQZTWDWSTVJISR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-9-7-14-16-8-13(12(4)20(14)18-9)10(2)17-11(3)15(21)19(5)6/h7-8,10-11,17H,1-6H3.
What are the key properties of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide?
2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide has a molecular weight of 289.38 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide is sourced from PubChem (CID 43573838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).