spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]

C13H12N2 — CID 154709221

IUPACspiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]
SMILESc1ccc2c(c1)NC1(CC1)c1cccn1-2
InChIInChI=1S/C13H12N2/c1-2-5-11-10(4-1)14-13(7-8-13)12-6-3-9-15(11)12/h1-6,9,14H,7-8H2
InChIKeyJTSOBPPFHGLCPI-UHFFFAOYSA-N
MW196.25 g/mol
LogP2.89
Rot. Bonds

About spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]

spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane] (PubChem CID 154709221) has the molecular formula C13H12N2 and a molecular weight of 196.25 g/mol. Its IUPAC name is spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane].

Molecular Properties

Compound Namespiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]
PubChem CID154709221
Molecular FormulaC13H12N2
Molecular Weight196.25 g/mol
Exact Mass196.10
IUPAC Namespiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]
SMILESc1ccc2c(c1)NC1(CC1)c1cccn1-2
InChIInChI=1S/C13H12N2/c1-2-5-11-10(4-1)14-13(7-8-13)12-6-3-9-15(11)12/h1-6,9,14H,7-8H2
InChIKeyJTSOBPPFHGLCPI-UHFFFAOYSA-N
XLogP2.89
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]?
The IUPAC name of spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane] (CID 154709221) is spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane].
What is the SMILES notation for spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]?
The canonical SMILES for spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane] is c1ccc2c(c1)NC1(CC1)c1cccn1-2.
What is the InChIKey of spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]?
The InChIKey is JTSOBPPFHGLCPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2/c1-2-5-11-10(4-1)14-13(7-8-13)12-6-3-9-15(11)12/h1-6,9,14H,7-8H2.
What are the key properties of spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane]?
spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane] has a molecular weight of 196.25 g/mol, XLogP of 2.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[5H-pyrrolo[1,2-a]quinoxaline-4,1'-cyclopropane] is sourced from PubChem (CID 154709221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).