6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine

C112H161N27O2 — CID 158720651

IUPAC6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine
SMILESCC(C)(C)c1cnc(C2CC2)nc1.CC(C)(C)c1cnc2cc(C3CC3)nn2c1.CC(C)(C)c1cnc2ccnn2c1.Cc1cc2ncc(C(C)(C)C)cn2n1.Cc1cc2ncc(C(C)(C)C)cn2n1.Cc1cnc(C(C)(C)C)cn1.Cc1cnc(OC(C)(C)C)cn1.Cc1cnc(OC(C)(C)C)nc1.Cc1nc2ccc(C(C)(C)C)cn2n1.Cc1ncc(C(C)(C)C)cn1.Cc1ncc(C(C)(C)C)cn1
InChIInChI=1S/C13H17N3.3C11H15N3.C11H16N2.C10H13N3.2C9H14N2O.3C9H14N2/c1-13(2,3)10-7-14-12-6-11(9-4-5-9)15-16(12)8-10;2*1-8-5-10-12-6-9(11(2,3)4)7-14(10)13-8;1-8-12-10-6-5-9(11(2,3)4)7-14(10)13-8;1-11(2,3)9-6-12-10(13-7-9)8-4-5-8;1-10(2,3)8-6-11-9-4-5-12-13(9)7-8;1-7-5-11-8(6-10-7)12-9(2,3)4;1-7-5-10-8(11-6-7)12-9(2,3)4;2*1-7-10-5-8(6-11-7)9(2,3)4;1-7-5-11-8(6-10-7)9(2,3)4/h6-9H,4-5H2,1-3H3;3*5-7H,1-4H3;6-8H,4-5H2,1-3H3;4-7H,1-3H3;2*5-6H,1-4H3;3*5-6H,1-4H3
InChIKeyIJWJQDDTAYKTNH-UHFFFAOYSA-N
MW1917.71 g/mol
LogP24.76
Rot. Bonds4

About 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine

6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine (PubChem CID 158720651) has the molecular formula C112H161N27O2 and a molecular weight of 1917.71 g/mol. Its IUPAC name is 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine.

Molecular Properties

Compound Name6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine
PubChem CID158720651
Molecular FormulaC112H161N27O2
Molecular Weight1917.71 g/mol
Exact Mass1916.33
IUPAC Name6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine
SMILESCC(C)(C)c1cnc(C2CC2)nc1.CC(C)(C)c1cnc2cc(C3CC3)nn2c1.CC(C)(C)c1cnc2ccnn2c1.Cc1cc2ncc(C(C)(C)C)cn2n1.Cc1cc2ncc(C(C)(C)C)cn2n1.Cc1cnc(C(C)(C)C)cn1.Cc1cnc(OC(C)(C)C)cn1.Cc1cnc(OC(C)(C)C)nc1.Cc1nc2ccc(C(C)(C)C)cn2n1.Cc1ncc(C(C)(C)C)cn1.Cc1ncc(C(C)(C)C)cn1
InChIInChI=1S/C13H17N3.3C11H15N3.C11H16N2.C10H13N3.2C9H14N2O.3C9H14N2/c1-13(2,3)10-7-14-12-6-11(9-4-5-9)15-16(12)8-10;2*1-8-5-10-12-6-9(11(2,3)4)7-14(10)13-8;1-8-12-10-6-5-9(11(2,3)4)7-14(10)13-8;1-11(2,3)9-6-12-10(13-7-9)8-4-5-8;1-10(2,3)8-6-11-9-4-5-12-13(9)7-8;1-7-5-11-8(6-10-7)12-9(2,3)4;1-7-5-10-8(11-6-7)12-9(2,3)4;2*1-7-10-5-8(6-11-7)9(2,3)4;1-7-5-11-8(6-10-7)9(2,3)4/h6-9H,4-5H2,1-3H3;3*5-7H,1-4H3;6-8H,4-5H2,1-3H3;4-7H,1-3H3;2*5-6H,1-4H3;3*5-6H,1-4H3
InChIKeyIJWJQDDTAYKTNH-UHFFFAOYSA-N
XLogP24.76
TPSA324.09 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds4
Heavy Atoms141
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001917.71
LogP ≤ 524.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Analyze 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine?
The IUPAC name of 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine (CID 158720651) is 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine.
What is the SMILES notation for 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine?
The canonical SMILES for 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine is CC(C)(C)c1cnc(C2CC2)nc1.CC(C)(C)c1cnc2cc(C3CC3)nn2c1.CC(C)(C)c1cnc2ccnn2c1.Cc1cc2ncc(C(C)(C)C)cn2n1.Cc1cc2ncc(C(C)(C)C)cn2n1.Cc1cnc(C(C)(C)C)cn1.Cc1cnc(OC(C)(C)C)cn1.Cc1cnc(OC(C)(C)C)nc1.Cc1nc2ccc(C(C)(C)C)cn2n1.Cc1ncc(C(C)(C)C)cn1.Cc1ncc(C(C)(C)C)cn1.
What is the InChIKey of 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine?
The InChIKey is IJWJQDDTAYKTNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3.3C11H15N3.C11H16N2.C10H13N3.2C9H14N2O.3C9H14N2/c1-13(2,3)10-7-14-12-6-11(9-4-5-9)15-16(12)8-10;2*1-8-5-10-12-6-9(11(2,3)4)7-14(10)13-8;1-8-12-10-6-5-9(11(2,3)4)7-14(10)13-8;1-11(2,3)9-6-12-10(13-7-9)8-4-5-8;1-10(2,3)8-6-11-9-4-5-12-13(9)7-8;1-7-5-11-8(6-10-7)12-9(2,3)4;1-7-5-10-8(11-6-7)12-9(2,3)4;2*1-7-10-5-8(6-11-7)9(2,3)4;1-7-5-11-8(6-10-7)9(2,3)4/h6-9H,4-5H2,1-3H3;3*5-7H,1-4H3;6-8H,4-5H2,1-3H3;4-7H,1-3H3;2*5-6H,1-4H3;3*5-6H,1-4H3.
What are the key properties of 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine?
6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine has a molecular weight of 1917.71 g/mol, XLogP of 24.76, 4 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-2-cyclopropylpyrazolo[1,5-a]pyrimidine;5-tert-butyl-2-cyclopropylpyrimidine;2-tert-butyl-5-methylpyrazine;bis(6-tert-butyl-2-methylpyrazolo[1,5-a]pyrimidine);bis(5-tert-butyl-2-methylpyrimidine);6-tert-butyl-2-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-tert-butylpyrazolo[1,5-a]pyrimidine;2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine;5-methyl-2-[(2-methylpropan-2-yl)oxy]pyrimidine is sourced from PubChem (CID 158720651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).