(5S)-5-hydroxy-1-methylimidazolidine-2,4-dione

C4H6N2O3 — CID 10057538

IUPAC(5S)-5-hydroxy-1-methylimidazolidine-2,4-dione
SMILESCN1C(=O)NC(=O)[C@@H]1O
InChIInChI=1S/C4H6N2O3/c1-6-3(8)2(7)5-4(6)9/h3,8H,1H3,(H,5,7,9)/t3-/m0/s1
InChIKeyUPSFNXFLBMJUQW-VKHMYHEASA-N
MW130.10 g/mol
LogP-1.51
Rot. Bonds

About (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione

(5S)-5-hydroxy-1-methylimidazolidine-2,4-dione (PubChem CID 10057538) has the molecular formula C4H6N2O3 and a molecular weight of 130.10 g/mol. Its IUPAC name is (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-hydroxy-1-methylimidazolidine-2,4-dione
PubChem CID10057538
Molecular FormulaC4H6N2O3
Molecular Weight130.10 g/mol
Exact Mass130.04
IUPAC Name(5S)-5-hydroxy-1-methylimidazolidine-2,4-dione
SMILESCN1C(=O)NC(=O)[C@@H]1O
InChIInChI=1S/C4H6N2O3/c1-6-3(8)2(7)5-4(6)9/h3,8H,1H3,(H,5,7,9)/t3-/m0/s1
InChIKeyUPSFNXFLBMJUQW-VKHMYHEASA-N
XLogP-1.51
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.10
LogP ≤ 5-1.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

(5S,6R)-5,6-dihydroxy-1-methyl-1,3-diazinane-2,4-dione
CID 131118895
5-(4-hydroxyphenyl)-1-methylimidazolidine-2,4-dione
CID 82112832
5-hydroxy-2,4-dioxoimidazolidine-1-carbaldehyde
CID 541443
1-methyl-5-sulfanylimidazolidine-2,4-dione;propane
CID 174538671
6-amino-5-bromo-1-methyl-1,3-diazinane-2,4-dione
CID 76844825
6-amino-5-bromo-1-methyl-1,3-diazinane-2,4-dione;hydrate
CID 78292337
3-hydroxy-5,6-dimethyl-4-propan-2-yl-1,3-dihydropyrazin-2-one
CID 163611020
6-hydroxy-1,3,5,5-tetramethyl-1,3-diazinane-2,4-dione
CID 135040297
(3R,4R)-3,4-dihydroxypyrrolidine-2,5-dione
CID 126575623
(5S,6S)-6-hydroxy-1,3,5-trimethyl-5-nitro-1,3-diazinane-2,4-dione
CID 7333015
(5S,6R)-5-fluoro-6-hydroxy-4-imino-1-methyl-1,3-diazinan-2-one
CID 146014533
(5S)-5-benzyl-1-methylimidazolidine-2,4-dione
CID 165148051

Frequently Asked Questions

What is the IUPAC name of (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione?
The IUPAC name of (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione (CID 10057538) is (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione is CN1C(=O)NC(=O)[C@@H]1O.
What is the InChIKey of (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione?
The InChIKey is UPSFNXFLBMJUQW-VKHMYHEASA-N. The full InChI is InChI=1S/C4H6N2O3/c1-6-3(8)2(7)5-4(6)9/h3,8H,1H3,(H,5,7,9)/t3-/m0/s1.
What are the key properties of (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione?
(5S)-5-hydroxy-1-methylimidazolidine-2,4-dione has a molecular weight of 130.10 g/mol, XLogP of -1.51, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-hydroxy-1-methylimidazolidine-2,4-dione is sourced from PubChem (CID 10057538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).