6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole

C14H16N2 — CID 69162320

IUPAC6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole
SMILESC1=CC2NC3C(C=CN4C=CCC34)C2C=C1
InChIInChI=1S/C14H16N2/c1-2-5-12-10(4-1)11-7-9-16-8-3-6-13(16)14(11)15-12/h1-5,7-15H,6H2
InChIKeyDVIKXUVHNDPCML-UHFFFAOYSA-N
MW212.30 g/mol
LogP1.80
Rot. Bonds

About 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole

6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole (PubChem CID 69162320) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole.

Molecular Properties

Compound Name6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole
PubChem CID69162320
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole
SMILESC1=CC2NC3C(C=CN4C=CCC34)C2C=C1
InChIInChI=1S/C14H16N2/c1-2-5-12-10(4-1)11-7-9-16-8-3-6-13(16)14(11)15-12/h1-5,7-15H,6H2
InChIKeyDVIKXUVHNDPCML-UHFFFAOYSA-N
XLogP1.80
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole?
The IUPAC name of 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole (CID 69162320) is 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole.
What is the SMILES notation for 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole?
The canonical SMILES for 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole is C1=CC2NC3C(C=CN4C=CCC34)C2C=C1.
What is the InChIKey of 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole?
The InChIKey is DVIKXUVHNDPCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-2-5-12-10(4-1)11-7-9-16-8-3-6-13(16)14(11)15-12/h1-5,7-15H,6H2.
What are the key properties of 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole?
6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole has a molecular weight of 212.30 g/mol, XLogP of 1.80, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6a,6b,10a,11,11a,11b-hexahydro-1H-indolizino[8,7-b]indole is sourced from PubChem (CID 69162320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).