7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine

C10H12N4 — CID 82404951

IUPAC7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine
SMILESc1cc(C2CCNC2)n2nccc2n1
InChIInChI=1S/C10H12N4/c1-4-11-7-8(1)9-2-5-12-10-3-6-13-14(9)10/h2-3,5-6,8,11H,1,4,7H2
InChIKeyKZQLFLLKNWGHMY-UHFFFAOYSA-N
MW188.23 g/mol
LogP0.81
Rot. Bonds1

About 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine

7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 82404951) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine
PubChem CID82404951
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine
SMILESc1cc(C2CCNC2)n2nccc2n1
InChIInChI=1S/C10H12N4/c1-4-11-7-8(1)9-2-5-12-10-3-6-13-14(9)10/h2-3,5-6,8,11H,1,4,7H2
InChIKeyKZQLFLLKNWGHMY-UHFFFAOYSA-N
XLogP0.81
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 82404941
3-(2-cyclopentylpyrazol-3-yl)piperidine
CID 102547955
7-piperidin-3-yl-2-propylpyrazolo[1,5-a]pyrimidine
CID 103315962
2-(2-methylpropyl)-7-piperidin-3-ylpyrazolo[1,5-a]pyrimidine
CID 103316447
7-piperidin-3-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
CID 24865424
3-(2-tert-butylpyrazol-3-yl)piperidine
CID 83392631
5-methyl-7-pyrrolidin-3-ylpyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 166973341
7-piperidin-3-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine;hydrochloride
CID 46737117
tert-butyl 3-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-1-carboxylate
CID 139481930
1H-indazol-3-yl-(4-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-1-yl)methanone
CID 110091319
7-piperidin-3-yl-2-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidine
CID 16670089
3-(7-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-2-yl)-1H-pyridin-2-one
CID 167436102

Frequently Asked Questions

What is the IUPAC name of 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine (CID 82404951) is 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine is c1cc(C2CCNC2)n2nccc2n1.
What is the InChIKey of 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is KZQLFLLKNWGHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-4-11-7-8(1)9-2-5-12-10-3-6-13-14(9)10/h2-3,5-6,8,11H,1,4,7H2.
What are the key properties of 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine?
7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 188.23 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 82404951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).