2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one

C8H9NO2 — CID 176888655

IUPAC2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one
SMILESCc1cc2c(o1)CCNC2=O
InChIInChI=1S/C8H9NO2/c1-5-4-6-7(11-5)2-3-9-8(6)10/h4H,2-3H2,1H3,(H,9,10)
InChIKeyQUNUTVRTTVKAAL-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.87
Rot. Bonds

About 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one

2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one (PubChem CID 176888655) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one
PubChem CID176888655
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one
SMILESCc1cc2c(o1)CCNC2=O
InChIInChI=1S/C8H9NO2/c1-5-4-6-7(11-5)2-3-9-8(6)10/h4H,2-3H2,1H3,(H,9,10)
InChIKeyQUNUTVRTTVKAAL-UHFFFAOYSA-N
XLogP0.87
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one?
The IUPAC name of 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one (CID 176888655) is 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one.
What is the SMILES notation for 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one?
The canonical SMILES for 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one is Cc1cc2c(o1)CCNC2=O.
What is the InChIKey of 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one?
The InChIKey is QUNUTVRTTVKAAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c1-5-4-6-7(11-5)2-3-9-8(6)10/h4H,2-3H2,1H3,(H,9,10).
What are the key properties of 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one?
2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one has a molecular weight of 151.16 g/mol, XLogP of 0.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6,7-dihydro-5H-furo[3,2-c]pyridin-4-one is sourced from PubChem (CID 176888655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).