1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one

C11H15NO2 — CID 139554620

IUPAC1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one
SMILESCc1oc(C(C)C)c2c1CN(C)C2=O
InChIInChI=1S/C11H15NO2/c1-6(2)10-9-8(7(3)14-10)5-12(4)11(9)13/h6H,5H2,1-4H3
InChIKeyIEXZKSIVNVHZHQ-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.30
Rot. Bonds1

About 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one

1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one (PubChem CID 139554620) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one.

Molecular Properties

Compound Name1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one
PubChem CID139554620
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one
SMILESCc1oc(C(C)C)c2c1CN(C)C2=O
InChIInChI=1S/C11H15NO2/c1-6(2)10-9-8(7(3)14-10)5-12(4)11(9)13/h6H,5H2,1-4H3
InChIKeyIEXZKSIVNVHZHQ-UHFFFAOYSA-N
XLogP2.30
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one?
The IUPAC name of 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one (CID 139554620) is 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one.
What is the SMILES notation for 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one?
The canonical SMILES for 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one is Cc1oc(C(C)C)c2c1CN(C)C2=O.
What is the InChIKey of 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one?
The InChIKey is IEXZKSIVNVHZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-6(2)10-9-8(7(3)14-10)5-12(4)11(9)13/h6H,5H2,1-4H3.
What are the key properties of 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one?
1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one has a molecular weight of 193.25 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-3-propan-2-yl-6H-furo[3,4-c]pyrrol-4-one is sourced from PubChem (CID 139554620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).