(5S)-5-propan-2-ylimidazolidine-2,4-dione

C6H10N2O2 — CID 853633

IUPAC(5S)-5-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)[C@@H]1NC(=O)NC1=O
InChIInChI=1S/C6H10N2O2/c1-3(2)4-5(9)8-6(10)7-4/h3-4H,1-2H3,(H2,7,8,9,10)/t4-/m0/s1
InChIKeyPBNUQCWZHRMSMS-BYPYZUCNSA-N
MW142.16 g/mol
LogP-0.15
Rot. Bonds1

About (5S)-5-propan-2-ylimidazolidine-2,4-dione

(5S)-5-propan-2-ylimidazolidine-2,4-dione (PubChem CID 853633) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is (5S)-5-propan-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-propan-2-ylimidazolidine-2,4-dione
PubChem CID853633
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name(5S)-5-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)[C@@H]1NC(=O)NC1=O
InChIInChI=1S/C6H10N2O2/c1-3(2)4-5(9)8-6(10)7-4/h3-4H,1-2H3,(H2,7,8,9,10)/t4-/m0/s1
InChIKeyPBNUQCWZHRMSMS-BYPYZUCNSA-N
XLogP-0.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-propan-2-ylimidazolidine-2,4-dione?
The IUPAC name of (5S)-5-propan-2-ylimidazolidine-2,4-dione (CID 853633) is (5S)-5-propan-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-propan-2-ylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-propan-2-ylimidazolidine-2,4-dione is CC(C)[C@@H]1NC(=O)NC1=O.
What is the InChIKey of (5S)-5-propan-2-ylimidazolidine-2,4-dione?
The InChIKey is PBNUQCWZHRMSMS-BYPYZUCNSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-3(2)4-5(9)8-6(10)7-4/h3-4H,1-2H3,(H2,7,8,9,10)/t4-/m0/s1.
What are the key properties of (5S)-5-propan-2-ylimidazolidine-2,4-dione?
(5S)-5-propan-2-ylimidazolidine-2,4-dione has a molecular weight of 142.16 g/mol, XLogP of -0.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-propan-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 853633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).