but-2-ene;1,3-dimethylimidazolidin-2-one;urea

C10H22N4O2 — CID 162037116

IUPACbut-2-ene;1,3-dimethylimidazolidin-2-one;urea
SMILESCC=CC.CN1CCN(C)C1=O.NC(N)=O
InChIInChI=1S/C5H10N2O.C4H8.CH4N2O/c1-6-3-4-7(2)5(6)8;1-3-4-2;2-1(3)4/h3-4H2,1-2H3;3-4H,1-2H3;(H4,2,3,4)
InChIKeyYWUGFWQCRVHIEA-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.59
Rot. Bonds

About but-2-ene;1,3-dimethylimidazolidin-2-one;urea

but-2-ene;1,3-dimethylimidazolidin-2-one;urea (PubChem CID 162037116) has the molecular formula C10H22N4O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is but-2-ene;1,3-dimethylimidazolidin-2-one;urea.

Molecular Properties

Compound Namebut-2-ene;1,3-dimethylimidazolidin-2-one;urea
PubChem CID162037116
Molecular FormulaC10H22N4O2
Molecular Weight230.31 g/mol
Exact Mass230.17
IUPAC Namebut-2-ene;1,3-dimethylimidazolidin-2-one;urea
SMILESCC=CC.CN1CCN(C)C1=O.NC(N)=O
InChIInChI=1S/C5H10N2O.C4H8.CH4N2O/c1-6-3-4-7(2)5(6)8;1-3-4-2;2-1(3)4/h3-4H2,1-2H3;3-4H,1-2H3;(H4,2,3,4)
InChIKeyYWUGFWQCRVHIEA-UHFFFAOYSA-N
XLogP0.59
TPSA92.66 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3-dimethylimidazolidin-2-one;hydrate
CID 68782599
1,3-dimethyl-1,3-diazepan-2-one
CID 27949
acetonitrile;1,3-dimethylimidazolidin-2-one
CID 69408679
1-iodo-3-methylimidazolidin-2-one
CID 129182782
1-methylpyrrolidin-2-one;urea
CID 141281161
1,3-dimethylimidazolidin-2-one;trimethyl phosphite
CID 174631101
4-(3-methyl-2-oxoimidazolidin-1-yl)butanehydrazide
CID 63577277
ethane;4-methyl-3-oxopiperazine-1-carboxamide
CID 143722944
4-[2-(3-methyl-2-oxoimidazolidin-1-yl)ethoxy]benzenecarbothioamide
CID 62489959
1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)
CID 160661672
2-(3-methyl-2-oxoimidazolidin-1-yl)acetaldehyde
CID 57135184
1-methyl-3-(5-oxohexyl)imidazolidin-2-one
CID 62491497

Frequently Asked Questions

What is the IUPAC name of but-2-ene;1,3-dimethylimidazolidin-2-one;urea?
The IUPAC name of but-2-ene;1,3-dimethylimidazolidin-2-one;urea (CID 162037116) is but-2-ene;1,3-dimethylimidazolidin-2-one;urea.
What is the SMILES notation for but-2-ene;1,3-dimethylimidazolidin-2-one;urea?
The canonical SMILES for but-2-ene;1,3-dimethylimidazolidin-2-one;urea is CC=CC.CN1CCN(C)C1=O.NC(N)=O.
What is the InChIKey of but-2-ene;1,3-dimethylimidazolidin-2-one;urea?
The InChIKey is YWUGFWQCRVHIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O.C4H8.CH4N2O/c1-6-3-4-7(2)5(6)8;1-3-4-2;2-1(3)4/h3-4H2,1-2H3;3-4H,1-2H3;(H4,2,3,4).
What are the key properties of but-2-ene;1,3-dimethylimidazolidin-2-one;urea?
but-2-ene;1,3-dimethylimidazolidin-2-one;urea has a molecular weight of 230.31 g/mol, XLogP of 0.59, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-ene;1,3-dimethylimidazolidin-2-one;urea is sourced from PubChem (CID 162037116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).