4-methyl-3H-furo[3,4-b]indol-1-one

C11H9NO2 — CID 138976579

IUPAC4-methyl-3H-furo[3,4-b]indol-1-one
SMILESCn1c2c(c3ccccc31)C(=O)OC2
InChIInChI=1S/C11H9NO2/c1-12-8-5-3-2-4-7(8)10-9(12)6-14-11(10)13/h2-5H,6H2,1H3
InChIKeyYRKHKVHNFVWEFQ-UHFFFAOYSA-N
MW187.20 g/mol
LogP1.85
Rot. Bonds

About 4-methyl-3H-furo[3,4-b]indol-1-one

4-methyl-3H-furo[3,4-b]indol-1-one (PubChem CID 138976579) has the molecular formula C11H9NO2 and a molecular weight of 187.20 g/mol. Its IUPAC name is 4-methyl-3H-furo[3,4-b]indol-1-one.

Molecular Properties

Compound Name4-methyl-3H-furo[3,4-b]indol-1-one
PubChem CID138976579
Molecular FormulaC11H9NO2
Molecular Weight187.20 g/mol
Exact Mass187.06
IUPAC Name4-methyl-3H-furo[3,4-b]indol-1-one
SMILESCn1c2c(c3ccccc31)C(=O)OC2
InChIInChI=1S/C11H9NO2/c1-12-8-5-3-2-4-7(8)10-9(12)6-14-11(10)13/h2-5H,6H2,1H3
InChIKeyYRKHKVHNFVWEFQ-UHFFFAOYSA-N
XLogP1.85
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3H-furo[3,4-b]indol-1-one?
The IUPAC name of 4-methyl-3H-furo[3,4-b]indol-1-one (CID 138976579) is 4-methyl-3H-furo[3,4-b]indol-1-one.
What is the SMILES notation for 4-methyl-3H-furo[3,4-b]indol-1-one?
The canonical SMILES for 4-methyl-3H-furo[3,4-b]indol-1-one is Cn1c2c(c3ccccc31)C(=O)OC2.
What is the InChIKey of 4-methyl-3H-furo[3,4-b]indol-1-one?
The InChIKey is YRKHKVHNFVWEFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO2/c1-12-8-5-3-2-4-7(8)10-9(12)6-14-11(10)13/h2-5H,6H2,1H3.
What are the key properties of 4-methyl-3H-furo[3,4-b]indol-1-one?
4-methyl-3H-furo[3,4-b]indol-1-one has a molecular weight of 187.20 g/mol, XLogP of 1.85, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3H-furo[3,4-b]indol-1-one is sourced from PubChem (CID 138976579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).