1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one

C13H18N6O — CID 56898719

IUPAC1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one
SMILESCc1cc(NCCN2CCNC2=O)n2nc(C)cc2n1
InChIInChI=1S/C13H18N6O/c1-9-7-11(19-12(16-9)8-10(2)17-19)14-3-5-18-6-4-15-13(18)20/h7-8,14H,3-6H2,1-2H3,(H,15,20)
InChIKeyWYOMYSBLAFVCLT-UHFFFAOYSA-N
MW274.33 g/mol
LogP0.78
Rot. Bonds4

About 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one

1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one (PubChem CID 56898719) has the molecular formula C13H18N6O and a molecular weight of 274.33 g/mol. Its IUPAC name is 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one
PubChem CID56898719
Molecular FormulaC13H18N6O
Molecular Weight274.33 g/mol
Exact Mass274.15
IUPAC Name1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one
SMILESCc1cc(NCCN2CCNC2=O)n2nc(C)cc2n1
InChIInChI=1S/C13H18N6O/c1-9-7-11(19-12(16-9)8-10(2)17-19)14-3-5-18-6-4-15-13(18)20/h7-8,14H,3-6H2,1-2H3,(H,15,20)
InChIKeyWYOMYSBLAFVCLT-UHFFFAOYSA-N
XLogP0.78
TPSA74.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[7-(dimethylamino)-2-methylpyrazolo[1,5-a]pyrimidin-5-yl]prop-2-enamide
CID 132317663
N-[2-(4,6-dimethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-pyrrolidin-1-ylacetamide
CID 2332241
2,5-Dimethyl-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 5308906
2,5-Dimethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 2768096
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, N(sup 4),7-dimethyl-, hydrochloride, hydrate (2:2:1)
CID 3054722
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, N,N',7-trimethyl-
CID 3054724
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, 7-methyl-N(sup 4)-2-propenyl-, hydrochloride, hydrate (1:1:1)
CID 3054727
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, 7-methyl-N(sup 4)-propyl-, hydrochloride
CID 3054730
2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(7S,8aS)-2-methyloctahydropyrrolo[1,2-a]pyrazin-7-yl]acetamide
CID 56753673
N-(2,5-dimethylpyrazol-3-yl)-2-(3-ethyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)acetamide
CID 56780136
N-(2,5-dimethylpyrazol-3-yl)-2-(3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)acetamide
CID 56780153
2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 56781632

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one (CID 56898719) is 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one is Cc1cc(NCCN2CCNC2=O)n2nc(C)cc2n1.
What is the InChIKey of 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one?
The InChIKey is WYOMYSBLAFVCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O/c1-9-7-11(19-12(16-9)8-10(2)17-19)14-3-5-18-6-4-15-13(18)20/h7-8,14H,3-6H2,1-2H3,(H,15,20).
What are the key properties of 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one?
1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one has a molecular weight of 274.33 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]imidazolidin-2-one is sourced from PubChem (CID 56898719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).