(5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one

C5H7NO4 — CID 89034026

IUPAC(5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one
SMILESC[C@@]1(N)OC(=O)C(O)=C1O
InChIInChI=1S/C5H7NO4/c1-5(6)3(8)2(7)4(9)10-5/h7-8H,6H2,1H3/t5-/m1/s1
InChIKeyDYRYJTPQPCXOJS-RXMQYKEDSA-N
MW145.11 g/mol
LogP-0.45
Rot. Bonds

About (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one

(5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one (PubChem CID 89034026) has the molecular formula C5H7NO4 and a molecular weight of 145.11 g/mol. Its IUPAC name is (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one.

Molecular Properties

Compound Name(5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one
PubChem CID89034026
Molecular FormulaC5H7NO4
Molecular Weight145.11 g/mol
Exact Mass145.04
IUPAC Name(5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one
SMILESC[C@@]1(N)OC(=O)C(O)=C1O
InChIInChI=1S/C5H7NO4/c1-5(6)3(8)2(7)4(9)10-5/h7-8H,6H2,1H3/t5-/m1/s1
InChIKeyDYRYJTPQPCXOJS-RXMQYKEDSA-N
XLogP-0.45
TPSA92.78 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.11
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(5S)-5-bromo-3,4-dihydroxy-5-[(1S)-1-hydroxyethyl]furan-2-one
CID 131724770
(5S)-5-[4-(4-bromophenyl)phenyl]-3,4-dihydroxy-5-methylfuran-2-one
CID 70240775
3-amino-3,6,6-trimethyl-1,4-dioxane-2,5-dione
CID 146407356
3,4-dihydroxy-5-(2-methylpropyl)-5-phenylfuran-2-one
CID 70133587
(5R,9S)-3,4,9-trihydroxy-1,7-dioxaspiro[4.4]non-3-ene-2,6-dione
CID 66843032
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-5-oxofuran-2-carbaldehyde
CID 141170520
(5S)-3,4-dihydroxy-5-phenyl-5-(4-phenylphenyl)furan-2-one
CID 139914960
3,4,5-trihydroxy-5-[(2-sulfanylethylamino)methyl]furan-2-one
CID 54680931
5-[4-(2-chloronaphthalen-1-yl)phenyl]-3,4-dihydroxy-5-methylfuran-2-one
CID 54708208
5-(hydroxymethylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 11137577
2-ethyl-4-hydroxy-2,5-dimethylfuran-3-one
CID 67094155
(5S)-4-hydroxy-3,5-dimethyl-5-[(1E,4E,6E)-3-oxoocta-1,4,6-trienyl]furan-2-one
CID 101416404

Frequently Asked Questions

What is the IUPAC name of (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one?
The IUPAC name of (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one (CID 89034026) is (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one.
What is the SMILES notation for (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one?
The canonical SMILES for (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one is C[C@@]1(N)OC(=O)C(O)=C1O.
What is the InChIKey of (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one?
The InChIKey is DYRYJTPQPCXOJS-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H7NO4/c1-5(6)3(8)2(7)4(9)10-5/h7-8H,6H2,1H3/t5-/m1/s1.
What are the key properties of (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one?
(5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one has a molecular weight of 145.11 g/mol, XLogP of -0.45, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-amino-3,4-dihydroxy-5-methylfuran-2-one is sourced from PubChem (CID 89034026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).