6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one

C15H14N2O2 — CID 90644008

IUPAC6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(Nc3cccc(O)c3)ccc2N1
InChIInChI=1S/C15H14N2O2/c18-13-3-1-2-11(9-13)16-12-5-6-14-10(8-12)4-7-15(19)17-14/h1-3,5-6,8-9,16,18H,4,7H2,(H,17,19)
InChIKeyKGSBJKYJWDJEPH-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.02
Rot. Bonds2

About 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one

6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 90644008) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one
PubChem CID90644008
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(Nc3cccc(O)c3)ccc2N1
InChIInChI=1S/C15H14N2O2/c18-13-3-1-2-11(9-13)16-12-5-6-14-10(8-12)4-7-15(19)17-14/h1-3,5-6,8-9,16,18H,4,7H2,(H,17,19)
InChIKeyKGSBJKYJWDJEPH-UHFFFAOYSA-N
XLogP3.02
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one (CID 90644008) is 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(Nc3cccc(O)c3)ccc2N1.
What is the InChIKey of 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is KGSBJKYJWDJEPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c18-13-3-1-2-11(9-13)16-12-5-6-14-10(8-12)4-7-15(19)17-14/h1-3,5-6,8-9,16,18H,4,7H2,(H,17,19).
What are the key properties of 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one?
6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 254.29 g/mol, XLogP of 3.02, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-hydroxyanilino)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 90644008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).