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

C15H23N5O — CID 104926763

IUPAC2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)CNC(C)c1cnc2cc(C)nn2c1C
InChIInChI=1S/C15H23N5O/c1-6-19(5)15(21)9-16-11(3)13-8-17-14-7-10(2)18-20(14)12(13)4/h7-8,11,16H,6,9H2,1-5H3
InChIKeyQXOBZGHIUPSMAM-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.48
Rot. Bonds5

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

2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide (PubChem CID 104926763) 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-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide
PubChem CID104926763
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)CNC(C)c1cnc2cc(C)nn2c1C
InChIInChI=1S/C15H23N5O/c1-6-19(5)15(21)9-16-11(3)13-8-17-14-7-10(2)18-20(14)12(13)4/h7-8,11,16H,6,9H2,1-5H3
InChIKeyQXOBZGHIUPSMAM-UHFFFAOYSA-N
XLogP1.48
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylacetamide
CID 43310816
methyl 3-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]propanoate
CID 43322248
N-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]-2-ethoxypropan-1-amine
CID 115888575
5-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]pentanamide
CID 106233305
2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylpropanamide
CID 43573838
3-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-2-methylpropane-1,2-diol
CID 66169884
(2R)-2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]butan-1-ol
CID 103922377
N-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]-3-methoxypropan-1-amine
CID 43205172
1-cyclopropyl-2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]ethanol
CID 63294854
[1-[[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]methyl]cyclopropyl]methanol
CID 115454498
methyl 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-2-methylpropanoate
CID 43725802
1-[[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]methyl]cyclohexan-1-ol
CID 111459377

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide?
The IUPAC name of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide (CID 104926763) is 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide is CCN(C)C(=O)CNC(C)c1cnc2cc(C)nn2c1C.
What is the InChIKey of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide?
The InChIKey is QXOBZGHIUPSMAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-6-19(5)15(21)9-16-11(3)13-8-17-14-7-10(2)18-20(14)12(13)4/h7-8,11,16H,6,9H2,1-5H3.
What are the key properties of 2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide?
2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N-ethyl-N-methylacetamide has a molecular weight of 289.38 g/mol, XLogP of 1.48, 5 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-ethyl-N-methylacetamide is sourced from PubChem (CID 104926763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).