2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine

C10H16N4 — CID 77052319

IUPAC2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine
SMILESNCCC1CC(c2cccnc2)NN1
InChIInChI=1S/C10H16N4/c11-4-3-9-6-10(14-13-9)8-2-1-5-12-7-8/h1-2,5,7,9-10,13-14H,3-4,6,11H2
InChIKeyZXAFYDRTCUZFDQ-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.34
Rot. Bonds3

About 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine

2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine (PubChem CID 77052319) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine.

Molecular Properties

Compound Name2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine
PubChem CID77052319
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine
SMILESNCCC1CC(c2cccnc2)NN1
InChIInChI=1S/C10H16N4/c11-4-3-9-6-10(14-13-9)8-2-1-5-12-7-8/h1-2,5,7,9-10,13-14H,3-4,6,11H2
InChIKeyZXAFYDRTCUZFDQ-UHFFFAOYSA-N
XLogP0.34
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine?
The IUPAC name of 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine (CID 77052319) is 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine.
What is the SMILES notation for 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine?
The canonical SMILES for 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine is NCCC1CC(c2cccnc2)NN1.
What is the InChIKey of 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine?
The InChIKey is ZXAFYDRTCUZFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c11-4-3-9-6-10(14-13-9)8-2-1-5-12-7-8/h1-2,5,7,9-10,13-14H,3-4,6,11H2.
What are the key properties of 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine?
2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine has a molecular weight of 192.27 g/mol, XLogP of 0.34, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-pyridin-3-ylpyrazolidin-3-yl)ethanamine is sourced from PubChem (CID 77052319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).