1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine

C15H20N6 — CID 63291941

IUPAC1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine
SMILESCc1cc2ncc(C(C)NCc3nccn3C)c(C)n2n1
InChIInChI=1S/C15H20N6/c1-10-7-14-18-8-13(12(3)21(14)19-10)11(2)17-9-15-16-5-6-20(15)4/h5-8,11,17H,9H2,1-4H3
InChIKeyJUKGVCDEVHUATG-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.93
Rot. Bonds4

About 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine

1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine (PubChem CID 63291941) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine
PubChem CID63291941
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC Name1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine
SMILESCc1cc2ncc(C(C)NCc3nccn3C)c(C)n2n1
InChIInChI=1S/C15H20N6/c1-10-7-14-18-8-13(12(3)21(14)19-10)11(2)17-9-15-16-5-6-20(15)4/h5-8,11,17H,9H2,1-4H3
InChIKeyJUKGVCDEVHUATG-UHFFFAOYSA-N
XLogP1.93
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-(pyridin-2-ylmethyl)ethanamine
CID 43201499
1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)ethanamine
CID 60978758
N-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]-2-ethoxypropan-1-amine
CID 115888575
1-(2,4-dimethylphenyl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine
CID 62350126
3-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-2-methylpropane-1,2-diol
CID 66169884
1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-methoxyethanamine
CID 82707253
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-(4-methylphenyl)propan-1-amine
CID 91646886
2-[1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]-N,N-dimethylacetamide
CID 43310816
[5-[[[(1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethyl]amino]methyl]-2-fluorophenyl]methanol
CID 97107840
(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]-1-methylsulfanylpropan-2-amine
CID 115888540

Frequently Asked Questions

What is the IUPAC name of 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine?
The IUPAC name of 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine (CID 63291941) is 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine.
What is the SMILES notation for 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine?
The canonical SMILES for 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine is Cc1cc2ncc(C(C)NCc3nccn3C)c(C)n2n1.
What is the InChIKey of 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine?
The InChIKey is JUKGVCDEVHUATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6/c1-10-7-14-18-8-13(12(3)21(14)19-10)11(2)17-9-15-16-5-6-20(15)4/h5-8,11,17H,9H2,1-4H3.
What are the key properties of 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine?
1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine has a molecular weight of 284.37 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[(1-methylimidazol-2-yl)methyl]ethanamine is sourced from PubChem (CID 63291941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).