2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one

C14H15NO3 — CID 10610359

IUPAC2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one
SMILESCC(C)(O)C1Cc2c(c3ccccc3[nH]c2=O)O1
InChIInChI=1S/C14H15NO3/c1-14(2,17)11-7-9-12(18-11)8-5-3-4-6-10(8)15-13(9)16/h3-6,11,17H,7H2,1-2H3,(H,15,16)
InChIKeyNUFIMLGUJYLVHW-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.60
Rot. Bonds1

About 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one

2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one (PubChem CID 10610359) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one.

Molecular Properties

Compound Name2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one
PubChem CID10610359
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one
SMILESCC(C)(O)C1Cc2c(c3ccccc3[nH]c2=O)O1
InChIInChI=1S/C14H15NO3/c1-14(2,17)11-7-9-12(18-11)8-5-3-4-6-10(8)15-13(9)16/h3-6,11,17H,7H2,1-2H3,(H,15,16)
InChIKeyNUFIMLGUJYLVHW-UHFFFAOYSA-N
XLogP1.60
TPSA62.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one?
The IUPAC name of 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one (CID 10610359) is 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one.
What is the SMILES notation for 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one?
The canonical SMILES for 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one is CC(C)(O)C1Cc2c(c3ccccc3[nH]c2=O)O1.
What is the InChIKey of 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one?
The InChIKey is NUFIMLGUJYLVHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-14(2,17)11-7-9-12(18-11)8-5-3-4-6-10(8)15-13(9)16/h3-6,11,17H,7H2,1-2H3,(H,15,16).
What are the key properties of 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one?
2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one has a molecular weight of 245.28 g/mol, XLogP of 1.60, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypropan-2-yl)-3,5-dihydro-2H-furo[3,2-c]quinolin-4-one is sourced from PubChem (CID 10610359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).