7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine

C12H11N5O — CID 126900378

IUPAC7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine
SMILESc1cnn(C2CN(c3nncc4ccoc34)C2)c1
InChIInChI=1S/C12H11N5O/c1-3-14-17(4-1)10-7-16(8-10)12-11-9(2-5-18-11)6-13-15-12/h1-6,10H,7-8H2
InChIKeySCCAHOLUGPSQLM-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.48
Rot. Bonds2

About 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine

7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine (PubChem CID 126900378) has the molecular formula C12H11N5O and a molecular weight of 241.25 g/mol. Its IUPAC name is 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine.

Molecular Properties

Compound Name7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine
PubChem CID126900378
Molecular FormulaC12H11N5O
Molecular Weight241.25 g/mol
Exact Mass241.10
IUPAC Name7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine
SMILESc1cnn(C2CN(c3nncc4ccoc34)C2)c1
InChIInChI=1S/C12H11N5O/c1-3-14-17(4-1)10-7-16(8-10)12-11-9(2-5-18-11)6-13-15-12/h1-6,10H,7-8H2
InChIKeySCCAHOLUGPSQLM-UHFFFAOYSA-N
XLogP1.48
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine?
The IUPAC name of 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine (CID 126900378) is 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine.
What is the SMILES notation for 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine?
The canonical SMILES for 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine is c1cnn(C2CN(c3nncc4ccoc34)C2)c1.
What is the InChIKey of 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine?
The InChIKey is SCCAHOLUGPSQLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O/c1-3-14-17(4-1)10-7-16(8-10)12-11-9(2-5-18-11)6-13-15-12/h1-6,10H,7-8H2.
What are the key properties of 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine?
7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine has a molecular weight of 241.25 g/mol, XLogP of 1.48, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-pyrazol-1-ylazetidin-1-yl)furo[2,3-d]pyridazine is sourced from PubChem (CID 126900378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).