ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine

C26H34N10 — CID 171509269

IUPACethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine
SMILESCC.CC.Cc1ccnc2cc(-c3cn(C)cn3)nn12.Cc1ccnc2cc(-c3cnn(C)c3)nn12
InChIInChI=1S/2C11H11N5.2C2H6/c1-8-3-4-12-11-5-10(14-16(8)11)9-6-13-15(2)7-9;1-8-3-4-12-11-5-9(14-16(8)11)10-6-15(2)7-13-10;2*1-2/h2*3-7H,1-2H3;2*1-2H3
InChIKeyOOUSUCPHHNBZHL-UHFFFAOYSA-N
MW486.63 g/mol
LogP4.93
Rot. Bonds2

About ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine

ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine (PubChem CID 171509269) has the molecular formula C26H34N10 and a molecular weight of 486.63 g/mol. Its IUPAC name is ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Nameethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine
PubChem CID171509269
Molecular FormulaC26H34N10
Molecular Weight486.63 g/mol
Exact Mass486.30
IUPAC Nameethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine
SMILESCC.CC.Cc1ccnc2cc(-c3cn(C)cn3)nn12.Cc1ccnc2cc(-c3cnn(C)c3)nn12
InChIInChI=1S/2C11H11N5.2C2H6/c1-8-3-4-12-11-5-10(14-16(8)11)9-6-13-15(2)7-9;1-8-3-4-12-11-5-9(14-16(8)11)10-6-15(2)7-13-10;2*1-2/h2*3-7H,1-2H3;2*1-2H3
InChIKeyOOUSUCPHHNBZHL-UHFFFAOYSA-N
XLogP4.93
TPSA96.02 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.63
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine with MolForge

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Related Compounds

7-chloro-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine
CID 171509239
4-tert-butyl-N-[2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]benzenesulfonamide
CID 118200756
2-(1-methylpyrazol-4-yl)-6-nitropyrazolo[1,5-a]pyrimidine
CID 67053225
[2-(1-methylpyrazol-4-yl)-4-pyridinyl]hydrazine
CID 102825252
4-(1-methylpyrazol-4-yl)pyrimidine
CID 3477787
1-(4-methylphenyl)-3,5-bis(1-methylpyrazol-4-yl)pyrazole
CID 19588182
3-methyl-6-[4-(1-methylpyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]imidazo[1,2-b]pyridazine
CID 168772951
1-[6-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethanol
CID 76618478
3-iodo-7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 154973002
4-(1-methylpyrazol-4-yl)-2-methylsulfonylpyrimidine
CID 67397716
2-methyl-3-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]pyridine
CID 141415020
2,4-dimethyl-5-[[2-(1-methylpyrazol-4-yl)-4-pyridinyl]oxy]pyridine
CID 123273621

Frequently Asked Questions

What is the IUPAC name of ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine (CID 171509269) is ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine is CC.CC.Cc1ccnc2cc(-c3cn(C)cn3)nn12.Cc1ccnc2cc(-c3cnn(C)c3)nn12.
What is the InChIKey of ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is OOUSUCPHHNBZHL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H11N5.2C2H6/c1-8-3-4-12-11-5-10(14-16(8)11)9-6-13-15(2)7-9;1-8-3-4-12-11-5-9(14-16(8)11)10-6-15(2)7-13-10;2*1-2/h2*3-7H,1-2H3;2*1-2H3.
What are the key properties of ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 486.63 g/mol, XLogP of 4.93, 2 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-methyl-2-(1-methylimidazol-4-yl)pyrazolo[1,5-a]pyrimidine;7-methyl-2-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 171509269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).