1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)

C80H73N11O7 — CID 159477334

About 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)

1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene) (PubChem CID 159477334) has the molecular formula C80H73N11O7 and a molecular weight of 1300.53 g/mol. Its IUPAC name is 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene).

Molecular Properties

• Compound Name: 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)
• PubChem CID: 159477334
• Molecular Formula: C80H73N11O7
• Molecular Weight: 1300.53 g/mol
• Exact Mass: 1299.57
• IUPAC Name: 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)
• SMILES: Cc1oc2c(cn3ccccc23)c1C.Cc1oc2c(cn3ccccc23)c1C.Cc1oc2c(nc3ccccn32)c1C.Cc1oc2c(nc3ccccn32)c1C.Cc1oc2cn3ccccc3c2c1C.Cc1oc2nc3ccccn3c2c1C.Cc1oc2nc3ccccn3c2c1C
• InChI: InChI=1S/3C12H11NO.4C11H10N2O/c2*1-8-9(2)14-12-10(8)7-13-6-4-3-5-11(12)13;1-8-9(2)14-11-7-13-6-4-3-5-10(13)12(8)11;2*1-7-8(2)14-11-10(7)13-6-4-3-5-9(13)12-11;2*1-7-8(2)14-11-10(7)12-9-5-3-4-6-13(9)11/h3*3-7H,1-2H3;4*3-6H,1-2H3
• InChIKey: LWNWUMPVAXTZSW-UHFFFAOYSA-N
• XLogP: 20.70
• TPSA: 174.41 Ų
• H-Bond Acceptors: 18
• Heavy Atoms: 98
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1300.53
LogP ≤ 5	20.70
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)?

The IUPAC name of 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene) (CID 159477334) is 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene).

What is the SMILES notation for 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)?

The canonical SMILES for 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene) is Cc1oc2c(cn3ccccc23)c1C.Cc1oc2c(cn3ccccc23)c1C.Cc1oc2c(nc3ccccn32)c1C.Cc1oc2c(nc3ccccn32)c1C.Cc1oc2cn3ccccc3c2c1C.Cc1oc2nc3ccccn3c2c1C.Cc1oc2nc3ccccn3c2c1C.

What is the InChIKey of 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)?

The InChIKey is LWNWUMPVAXTZSW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H11NO.4C11H10N2O/c2*1-8-9(2)14-12-10(8)7-13-6-4-3-5-11(12)13;1-8-9(2)14-11-7-13-6-4-3-5-10(13)12(8)11;2*1-7-8(2)14-11-10(7)13-6-4-3-5-9(13)12-11;2*1-7-8(2)14-11-10(7)12-9-5-3-4-6-13(9)11/h3*3-7H,1-2H3;4*3-6H,1-2H3.

What are the key properties of 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene)?

1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene) has a molecular weight of 1300.53 g/mol, XLogP of 20.70, 0 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2-dimethylfuro[3,2-a]indolizine;bis(2,3-dimethylfuro[2,3-a]indolizine);bis(3,4-dimethyl-5-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaene);bis(4,5-dimethyl-3-oxa-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),4,7,9,11-pentaene) is sourced from PubChem (CID 159477334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).