4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole

C7H11N3 — CID 96637487

IUPAC4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole
SMILESc1n[nH]cc1[C@H]1CCNC1
InChIInChI=1S/C7H11N3/c1-2-8-3-6(1)7-4-9-10-5-7/h4-6,8H,1-3H2,(H,9,10)/t6-/m0/s1
InChIKeyXPDOYXLHSAFZTP-LURJTMIESA-N
MW137.19 g/mol
LogP0.49
Rot. Bonds1

About 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole

4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole (PubChem CID 96637487) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole.

Molecular Properties

Compound Name4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole
PubChem CID96637487
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole
SMILESc1n[nH]cc1[C@H]1CCNC1
InChIInChI=1S/C7H11N3/c1-2-8-3-6(1)7-4-9-10-5-7/h4-6,8H,1-3H2,(H,9,10)/t6-/m0/s1
InChIKeyXPDOYXLHSAFZTP-LURJTMIESA-N
XLogP0.49
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-pyrrolidin-3-ylpyrimidine
CID 66996535
tert-butyl formate;4-(1H-pyrazol-4-yl)piperidine
CID 174736091
1-(piperidin-4-ylmethyl)-4-(1H-pyrazol-4-yl)piperidine
CID 120847965
4-(oxolan-3-yl)-1H-pyrazole
CID 126851922
3-pyrrolidin-3-ylpyridine
CID 3613651
4-pyrrolidin-3-yl-2H-triazole
CID 54238328
3-dimethylphosphoryl-5-(1H-pyrazol-4-yl)piperidine;hydrochloride
CID 155755190
3-(1H-pyrazol-4-yl)-6-azabicyclo[3.2.1]octane
CID 57485692
3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine
CID 96736316
4-(pyrrolidin-3-ylmethyl)-1H-pyrazole
CID 83479564
5-pyrrolidin-3-yl-1H-indazole
CID 82405322
CID 156632351
CID 156632351

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole?
The IUPAC name of 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole (CID 96637487) is 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole.
What is the SMILES notation for 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole?
The canonical SMILES for 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole is c1n[nH]cc1[C@H]1CCNC1.
What is the InChIKey of 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole?
The InChIKey is XPDOYXLHSAFZTP-LURJTMIESA-N. The full InChI is InChI=1S/C7H11N3/c1-2-8-3-6(1)7-4-9-10-5-7/h4-6,8H,1-3H2,(H,9,10)/t6-/m0/s1.
What are the key properties of 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole?
4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole has a molecular weight of 137.19 g/mol, XLogP of 0.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole is sourced from PubChem (CID 96637487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).