2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol

C14H15N3O2 — CID 175959585

IUPAC2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol
SMILESOc1ccccc1-c1ccc(OC2CCNC2)nn1
InChIInChI=1S/C14H15N3O2/c18-13-4-2-1-3-11(13)12-5-6-14(17-16-12)19-10-7-8-15-9-10/h1-6,10,15,18H,7-9H2
InChIKeyULFHRQKPVWLDQZ-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.59
Rot. Bonds3

About 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol

2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol (PubChem CID 175959585) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol.

Molecular Properties

Compound Name2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol
PubChem CID175959585
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol
SMILESOc1ccccc1-c1ccc(OC2CCNC2)nn1
InChIInChI=1S/C14H15N3O2/c18-13-4-2-1-3-11(13)12-5-6-14(17-16-12)19-10-7-8-15-9-10/h1-6,10,15,18H,7-9H2
InChIKeyULFHRQKPVWLDQZ-UHFFFAOYSA-N
XLogP1.59
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol?
The IUPAC name of 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol (CID 175959585) is 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol.
What is the SMILES notation for 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol?
The canonical SMILES for 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol is Oc1ccccc1-c1ccc(OC2CCNC2)nn1.
What is the InChIKey of 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol?
The InChIKey is ULFHRQKPVWLDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c18-13-4-2-1-3-11(13)12-5-6-14(17-16-12)19-10-7-8-15-9-10/h1-6,10,15,18H,7-9H2.
What are the key properties of 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol?
2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol has a molecular weight of 257.29 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyrrolidin-3-yloxypyridazin-3-yl)phenol is sourced from PubChem (CID 175959585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).