(2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one

C17H15NO2 — CID 25257271

IUPAC(2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one
SMILESO=C1C=C(NCc2ccccc2)[C@@H](c2ccccc2)O1
InChIInChI=1S/C17H15NO2/c19-16-11-15(18-12-13-7-3-1-4-8-13)17(20-16)14-9-5-2-6-10-14/h1-11,17-18H,12H2/t17-/m1/s1
InChIKeyNAPFISPKKLPOFZ-QGZVFWFLSA-N
MW265.31 g/mol
LogP2.96
Rot. Bonds4

About (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one

(2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one (PubChem CID 25257271) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one.

Molecular Properties

Compound Name(2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one
PubChem CID25257271
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name(2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one
SMILESO=C1C=C(NCc2ccccc2)[C@@H](c2ccccc2)O1
InChIInChI=1S/C17H15NO2/c19-16-11-15(18-12-13-7-3-1-4-8-13)17(20-16)14-9-5-2-6-10-14/h1-11,17-18H,12H2/t17-/m1/s1
InChIKeyNAPFISPKKLPOFZ-QGZVFWFLSA-N
XLogP2.96
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-oxo-2-phenyl-2H-furan-3-carboxylic acid
CID 70388760
2-phenyl-3-(trifluoromethyl)-2H-furan-5-one
CID 11287612
(2S)-3-ethoxy-2-phenyl-2H-furan-5-one
CID 102003164
4-(benzylamino)-5,5-dimethylfuran-2-one
CID 102422900
2-phenyl-3-prop-2-enyl-2H-furan-5-one
CID 102338202
(2R)-3-ethoxy-2-phenyl-2H-furan-5-one
CID 102003165
2-phenyl-3-phenyltellanyl-2H-furan-5-one
CID 134932502
(3R,6S)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432934
(3R,6R)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432935
(3S)-3-phenyl-3H-2-benzofuran-1-one
CID 725855
1,4,5,8-tetrakis(benzylamino)anthracene-9,10-dione
CID 154150456
2-N,4-N,6-N-tribenzyl-1,3,5-triazine-2,4,6-triamine
CID 11372871

Frequently Asked Questions

What is the IUPAC name of (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one?
The IUPAC name of (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one (CID 25257271) is (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one.
What is the SMILES notation for (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one?
The canonical SMILES for (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one is O=C1C=C(NCc2ccccc2)[C@@H](c2ccccc2)O1.
What is the InChIKey of (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one?
The InChIKey is NAPFISPKKLPOFZ-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H15NO2/c19-16-11-15(18-12-13-7-3-1-4-8-13)17(20-16)14-9-5-2-6-10-14/h1-11,17-18H,12H2/t17-/m1/s1.
What are the key properties of (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one?
(2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one has a molecular weight of 265.31 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one is sourced from PubChem (CID 25257271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).