3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione

C10H19N3O3 — CID 3133125

IUPAC3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCN(C)CC(O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C10H19N3O3/c1-10(2)8(15)13(9(16)11-10)6-7(14)5-12(3)4/h7,14H,5-6H2,1-4H3,(H,11,16)
InChIKeyQMTVFLPQQFBNTL-UHFFFAOYSA-N
MW229.28 g/mol
LogP-0.76
Rot. Bonds4

About 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione

3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 3133125) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
PubChem CID3133125
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCN(C)CC(O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C10H19N3O3/c1-10(2)8(15)13(9(16)11-10)6-7(14)5-12(3)4/h7,14H,5-6H2,1-4H3,(H,11,16)
InChIKeyQMTVFLPQQFBNTL-UHFFFAOYSA-N
XLogP-0.76
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-Hydroxyethyl)-5,5-dimethylhydantoin
CID 99605
1,3-Bis(2-hydroxyethyl)-5,5-dimethyl-2,4-imidazolidinedione
CID 117879
3-[2-Hydroxy-3-(4-morpholinyl)propyl]-5,5-dimethylimidazolidine-2,4-dione
CID 647728
3-(2-Hydroxy-3-piperidin-1-yl-propyl)-5,5-dimethyl-imidazolidine-2,4-dione
CID 650277
3-[3-(Diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
CID 2909095
3,3'-(2-Hydroxypropane-1,3-diyl)bis(5,5-dimethylimidazolidine-2,4-dione)
CID 648961
3-[2-Hydroxy-3-(1-pyrrolidinyl)propyl]-5,5-dimethyl-2,4-imidazolidinedione
CID 2909886
Mercury, chloro((3-(5,5-dimethyl-2,4-dioxo-3-imidazolidinyl)-2-methoxy)propyl)-
CID 18993
3-[3-(2,5-Dioxopyrrolidin-1-yl)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
CID 652154
3-[3-(Dibutylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
CID 2884173
3-[3-(Dipropylamino)-2-hydroxypropyl]-5,5-dimethyl-2,4-imidazolidinedione
CID 3145439
3-[3-(Diallylamino)-2-hydroxypropyl]-5,5-dimethyl-2,4-imidazolidinedione
CID 2884424

Frequently Asked Questions

What is the IUPAC name of 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione (CID 3133125) is 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione is CN(C)CC(O)CN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is QMTVFLPQQFBNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-10(2)8(15)13(9(16)11-10)6-7(14)5-12(3)4/h7,14H,5-6H2,1-4H3,(H,11,16).
What are the key properties of 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 229.28 g/mol, XLogP of -0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(dimethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 3133125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).