5-methylidene-3-propan-2-ylimidazolidine-2,4-dione

C7H10N2O2 — CID 20515719

IUPAC5-methylidene-3-propan-2-ylimidazolidine-2,4-dione
SMILESC=C1NC(=O)N(C(C)C)C1=O
InChIInChI=1S/C7H10N2O2/c1-4(2)9-6(10)5(3)8-7(9)11/h4H,3H2,1-2H3,(H,8,11)
InChIKeyCMEWLWUPUCYEFG-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.46
Rot. Bonds1

About 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione

5-methylidene-3-propan-2-ylimidazolidine-2,4-dione (PubChem CID 20515719) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-methylidene-3-propan-2-ylimidazolidine-2,4-dione
PubChem CID20515719
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name5-methylidene-3-propan-2-ylimidazolidine-2,4-dione
SMILESC=C1NC(=O)N(C(C)C)C1=O
InChIInChI=1S/C7H10N2O2/c1-4(2)9-6(10)5(3)8-7(9)11/h4H,3H2,1-2H3,(H,8,11)
InChIKeyCMEWLWUPUCYEFG-UHFFFAOYSA-N
XLogP0.46
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

5-(Dimethylamino)uracil
CID 255552
n3-Methyl-5-methylaminouracil
CID 67427146
5-(pyrrolidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 17275048
1-Acetyl-5-methylideneimidazolidine-2,4-dione
CID 11788405
5-Acetylamino-3-methyl-uracil
CID 129852102
Hydantoinylacrylamide
CID 129864504
(1,3-Dimethyl-2,4-dioxopyrimidin-5-yl)urea
CID 129934868
5-(Diethylamino)uracil
CID 3487741
1-(2-Isopropylaminoacrylyl)-3-methylimidazolidone
CID 611083
(5Z)-5-(dimethylaminomethylidene)imidazolidine-2,4-dione
CID 11480564
3-n-Butyl-5-methylenehydantoin
CID 12767207
(Z)-3-n-Butyl-5-ethylidene-2,4-imidazolidinedione
CID 12767212

Frequently Asked Questions

What is the IUPAC name of 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione?
The IUPAC name of 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione (CID 20515719) is 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione?
The canonical SMILES for 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione is C=C1NC(=O)N(C(C)C)C1=O.
What is the InChIKey of 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione?
The InChIKey is CMEWLWUPUCYEFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-4(2)9-6(10)5(3)8-7(9)11/h4H,3H2,1-2H3,(H,8,11).
What are the key properties of 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione?
5-methylidene-3-propan-2-ylimidazolidine-2,4-dione has a molecular weight of 154.17 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-3-propan-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 20515719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).