3-pyrrolidin-1-yl-1H-pyrazol-5-amine

C7H12N4 — CID 45088327

IUPAC3-pyrrolidin-1-yl-1H-pyrazol-5-amine
SMILESNc1cc(N2CCCC2)n[nH]1
InChIInChI=1S/C7H12N4/c8-6-5-7(10-9-6)11-3-1-2-4-11/h5H,1-4H2,(H3,8,9,10)
InChIKeyHPXYJYSRMZFPAT-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.59
Rot. Bonds1

About 3-pyrrolidin-1-yl-1H-pyrazol-5-amine

3-pyrrolidin-1-yl-1H-pyrazol-5-amine (PubChem CID 45088327) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is 3-pyrrolidin-1-yl-1H-pyrazol-5-amine.

Molecular Properties

Compound Name3-pyrrolidin-1-yl-1H-pyrazol-5-amine
PubChem CID45088327
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name3-pyrrolidin-1-yl-1H-pyrazol-5-amine
SMILESNc1cc(N2CCCC2)n[nH]1
InChIInChI=1S/C7H12N4/c8-6-5-7(10-9-6)11-3-1-2-4-11/h5H,1-4H2,(H3,8,9,10)
InChIKeyHPXYJYSRMZFPAT-UHFFFAOYSA-N
XLogP0.59
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-1-yl-1H-pyrazol-5-amine?
The IUPAC name of 3-pyrrolidin-1-yl-1H-pyrazol-5-amine (CID 45088327) is 3-pyrrolidin-1-yl-1H-pyrazol-5-amine.
What is the SMILES notation for 3-pyrrolidin-1-yl-1H-pyrazol-5-amine?
The canonical SMILES for 3-pyrrolidin-1-yl-1H-pyrazol-5-amine is Nc1cc(N2CCCC2)n[nH]1.
What is the InChIKey of 3-pyrrolidin-1-yl-1H-pyrazol-5-amine?
The InChIKey is HPXYJYSRMZFPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c8-6-5-7(10-9-6)11-3-1-2-4-11/h5H,1-4H2,(H3,8,9,10).
What are the key properties of 3-pyrrolidin-1-yl-1H-pyrazol-5-amine?
3-pyrrolidin-1-yl-1H-pyrazol-5-amine has a molecular weight of 152.20 g/mol, XLogP of 0.59, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-1-yl-1H-pyrazol-5-amine is sourced from PubChem (CID 45088327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).