1-(5-methylindolo[3,2-b]indol-10-yl)ethanone

C17H14N2O — CID 762542

IUPAC1-(5-methylindolo[3,2-b]indol-10-yl)ethanone
SMILESCC(=O)n1c2ccccc2c2c1c1ccccc1n2C
InChIInChI=1S/C17H14N2O/c1-11(20)19-15-10-6-4-8-13(15)16-17(19)12-7-3-5-9-14(12)18(16)2/h3-10H,1-2H3
InChIKeyAIZYMMAATPBKQJ-UHFFFAOYSA-N
MW262.31 g/mol
LogP3.95
Rot. Bonds

About 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone

1-(5-methylindolo[3,2-b]indol-10-yl)ethanone (PubChem CID 762542) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone.

Molecular Properties

Compound Name1-(5-methylindolo[3,2-b]indol-10-yl)ethanone
PubChem CID762542
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name1-(5-methylindolo[3,2-b]indol-10-yl)ethanone
SMILESCC(=O)n1c2ccccc2c2c1c1ccccc1n2C
InChIInChI=1S/C17H14N2O/c1-11(20)19-15-10-6-4-8-13(15)16-17(19)12-7-3-5-9-14(12)18(16)2/h3-10H,1-2H3
InChIKeyAIZYMMAATPBKQJ-UHFFFAOYSA-N
XLogP3.95
TPSA26.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone?
The IUPAC name of 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone (CID 762542) is 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone.
What is the SMILES notation for 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone?
The canonical SMILES for 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone is CC(=O)n1c2ccccc2c2c1c1ccccc1n2C.
What is the InChIKey of 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone?
The InChIKey is AIZYMMAATPBKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O/c1-11(20)19-15-10-6-4-8-13(15)16-17(19)12-7-3-5-9-14(12)18(16)2/h3-10H,1-2H3.
What are the key properties of 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone?
1-(5-methylindolo[3,2-b]indol-10-yl)ethanone has a molecular weight of 262.31 g/mol, XLogP of 3.95, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylindolo[3,2-b]indol-10-yl)ethanone is sourced from PubChem (CID 762542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).