XNAZVRGJPIDDOQ-UHFFFAOYSA-N

C₈H₁₆N₂O — CID 50944249

About XNAZVRGJPIDDOQ-UHFFFAOYSA-N

XNAZVRGJPIDDOQ-UHFFFAOYSA-N (PubChem CID 50944249) has the molecular formula C₈H₁₆N₂O and a molecular weight of 156.23 g/mol. Its IUPAC name is 4-pyrrolidin-1-ylpyrrolidin-3-ol.

Molecular Properties

• Compound Name: XNAZVRGJPIDDOQ-UHFFFAOYSA-N
• PubChem CID: 50944249
• Molecular Formula: C₈H₁₆N₂O
• Molecular Weight: 156.23 g/mol
• Exact Mass: 156.13
• IUPAC Name: 4-pyrrolidin-1-ylpyrrolidin-3-ol
• SMILES: OC1CNCC1N1CCCC1
• InChI: InChI=1S/C8H16N2O/c11-8-6-9-5-7(8)10-3-1-2-4-10/h7-9,11H,1-6H2
• InChIKey: XNAZVRGJPIDDOQ-UHFFFAOYSA-N
• XLogP: -0.59
• TPSA: 35.50 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 1
• Heavy Atoms: 11
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	156.23
LogP ≤ 5	-0.59
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of XNAZVRGJPIDDOQ-UHFFFAOYSA-N?

The IUPAC name of XNAZVRGJPIDDOQ-UHFFFAOYSA-N (CID 50944249) is 4-pyrrolidin-1-ylpyrrolidin-3-ol.

What is the SMILES notation for XNAZVRGJPIDDOQ-UHFFFAOYSA-N?

The canonical SMILES for XNAZVRGJPIDDOQ-UHFFFAOYSA-N is OC1CNCC1N1CCCC1.

What is the InChIKey of XNAZVRGJPIDDOQ-UHFFFAOYSA-N?

The InChIKey is XNAZVRGJPIDDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c11-8-6-9-5-7(8)10-3-1-2-4-10/h7-9,11H,1-6H2.

What are the key properties of XNAZVRGJPIDDOQ-UHFFFAOYSA-N?

XNAZVRGJPIDDOQ-UHFFFAOYSA-N has a molecular weight of 156.23 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 XNAZVRGJPIDDOQ-UHFFFAOYSA-N is sourced from PubChem (CID 50944249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 50944249 — identifiers, structure, computed properties (public domain)

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