7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine

C14H16N6 — CID 53183291

IUPAC7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1nccn1-c1cc(N2CCCC2)nc2ccnn12
InChIInChI=1S/C14H16N6/c1-11-15-6-9-19(11)14-10-13(18-7-2-3-8-18)17-12-4-5-16-20(12)14/h4-6,9-10H,2-3,7-8H2,1H3
InChIKeyMUIFPWNDKSWQKE-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.82
Rot. Bonds2

About 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine

7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 53183291) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
PubChem CID53183291
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC Name7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1nccn1-c1cc(N2CCCC2)nc2ccnn12
InChIInChI=1S/C14H16N6/c1-11-15-6-9-19(11)14-10-13(18-7-2-3-8-18)17-12-4-5-16-20(12)14/h4-6,9-10H,2-3,7-8H2,1H3
InChIKeyMUIFPWNDKSWQKE-UHFFFAOYSA-N
XLogP1.82
TPSA51.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-Ethyl-8-methyl-2-(2-(1-methyl-3-(pyrrolidin-1-yl)-1H-1,2,4-triazol-5-yl)ethyl)-[1,2,4]triazolo[1,5-c]pyrimidine
CID 72705092
5,8-dimethyl-2-[(E)-2-(2-methyl-5-pyrrolidin-1-yl-2H-[1,2,4]triazol-3-yl)-vinyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CID 90018218
N-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-3-(1-methylpyrazol-3-yl)triazolo[4,5-d]pyrimidin-5-amine
CID 89720115
2,6-Bis(1-pyrazolyl)pyrazine
CID 1487780
5,8-dimethyl-2-[(E)-2-(1-methyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)ethenyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CID 165415044
5,8-dimethyl-2-[(E)-2-(1-methyl-4-pyrrolidin-1-ylimidazol-2-yl)ethenyl]-[1,2,4]triazolo[1,5-a]pyrazine
CID 165415113
8-Bromo-5-methyl-2-[2-(2-methyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CID 165415148
5-Methyl-2-[2-(2-methyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CID 165415181
5,8-Dimethyl-2-[2-(2-methyl-5-pyrazol-1-yl-1,2,4-triazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyrazine
CID 165415248
5,8-dimethyl-2-[(E)-2-[2-methyl-5-(2-methylpyrazolidin-1-yl)-1,2,4-triazol-3-yl]ethenyl]-[1,2,4]triazolo[1,5-a]pyrazine
CID 165415280
2-[(E)-2-(2-ethyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)ethenyl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazine
CID 72704117
5,8-Dimethyl-2-[2-(2-methyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CID 72705285

Frequently Asked Questions

What is the IUPAC name of 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine (CID 53183291) is 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine is Cc1nccn1-c1cc(N2CCCC2)nc2ccnn12.
What is the InChIKey of 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is MUIFPWNDKSWQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-11-15-6-9-19(11)14-10-13(18-7-2-3-8-18)17-12-4-5-16-20(12)14/h4-6,9-10H,2-3,7-8H2,1H3.
What are the key properties of 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine?
7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 268.32 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methylimidazol-1-yl)-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 53183291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).