3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline

C10H10N2 — CID 143408641

IUPAC3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline
SMILESCC1=NC2=CC=CC3CC23N=C1
InChIInChI=1S/C10H10N2/c1-7-6-11-10-5-8(10)3-2-4-9(10)12-7/h2-4,6,8H,5H2,1H3
InChIKeyBZVXCAGFNWSTAM-UHFFFAOYSA-N
MW158.20 g/mol
LogP1.74
Rot. Bonds

About 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline

3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline (PubChem CID 143408641) has the molecular formula C10H10N2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline.

Molecular Properties

Compound Name3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline
PubChem CID143408641
Molecular FormulaC10H10N2
Molecular Weight158.20 g/mol
Exact Mass158.08
IUPAC Name3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline
SMILESCC1=NC2=CC=CC3CC23N=C1
InChIInChI=1S/C10H10N2/c1-7-6-11-10-5-8(10)3-2-4-9(10)12-7/h2-4,6,8H,5H2,1H3
InChIKeyBZVXCAGFNWSTAM-UHFFFAOYSA-N
XLogP1.74
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6,6a-dihydro-5aH-cyclopropa[g]quinoxaline;ethane
CID 143157892
Ethane;3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline
CID 143408640
6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane
CID 144216551
2,9-Diazatetracyclo[8.5.0.01,14.03,8]pentadeca-2,4,6,8,10,12-hexaene
CID 144989126
Ethane;6,12,15-triazatetracyclo[9.4.0.01,3.05,10]pentadeca-4,6,8,10,12,14-hexaene
CID 145322438
3,4a,5-trimethyl-5H-quinoxaline
CID 163480902
6,6a-dihydro-5aH-cyclopropa[g]quinoxaline
CID 143157893
6,12,15-Triazatetracyclo[9.4.0.01,3.05,10]pentadeca-4,6,8,10,12,14-hexaene
CID 145322439
4-methyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline
CID 155731562

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline?
The IUPAC name of 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline (CID 143408641) is 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline.
What is the SMILES notation for 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline?
The canonical SMILES for 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline is CC1=NC2=CC=CC3CC23N=C1.
What is the InChIKey of 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline?
The InChIKey is BZVXCAGFNWSTAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2/c1-7-6-11-10-5-8(10)3-2-4-9(10)12-7/h2-4,6,8H,5H2,1H3.
What are the key properties of 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline?
3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline has a molecular weight of 158.20 g/mol, XLogP of 1.74, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7a,8-dihydrocyclopropa[e]quinoxaline is sourced from PubChem (CID 143408641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).