furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone

C15H16N4O2 — CID 97472727

IUPACfuran-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone
SMILESO=C(c1ccoc1)N1CCC2(C1)CN(c1ncccn1)C2
InChIInChI=1S/C15H16N4O2/c20-13(12-2-7-21-8-12)18-6-3-15(9-18)10-19(11-15)14-16-4-1-5-17-14/h1-2,4-5,7-8H,3,6,9-11H2
InChIKeyFGGBLYVLYCSPRF-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.42
Rot. Bonds2

About furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone

furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone (PubChem CID 97472727) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone.

Molecular Properties

Compound Namefuran-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone
PubChem CID97472727
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Namefuran-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone
SMILESO=C(c1ccoc1)N1CCC2(C1)CN(c1ncccn1)C2
InChIInChI=1S/C15H16N4O2/c20-13(12-2-7-21-8-12)18-6-3-15(9-18)10-19(11-15)14-16-4-1-5-17-14/h1-2,4-5,7-8H,3,6,9-11H2
InChIKeyFGGBLYVLYCSPRF-UHFFFAOYSA-N
XLogP1.42
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
The IUPAC name of furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone (CID 97472727) is furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone.
What is the SMILES notation for furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
The canonical SMILES for furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone is O=C(c1ccoc1)N1CCC2(C1)CN(c1ncccn1)C2.
What is the InChIKey of furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
The InChIKey is FGGBLYVLYCSPRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c20-13(12-2-7-21-8-12)18-6-3-15(9-18)10-19(11-15)14-16-4-1-5-17-14/h1-2,4-5,7-8H,3,6,9-11H2.
What are the key properties of furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone?
furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone has a molecular weight of 284.32 g/mol, XLogP of 1.42, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-(2-pyrimidin-2-yl-2,7-diazaspiro[3.4]octan-7-yl)methanone is sourced from PubChem (CID 97472727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).