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

C12H23N3O3 — CID 2909095

IUPAC3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN(CC)CC(O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C12H23N3O3/c1-5-14(6-2)7-9(16)8-15-10(17)12(3,4)13-11(15)18/h9,16H,5-8H2,1-4H3,(H,13,18)
InChIKeyNVZJRQFSGFQQHN-UHFFFAOYSA-N
MW257.33 g/mol
LogP0.02
Rot. Bonds6

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

3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 2909095) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
PubChem CID2909095
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC Name3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCCN(CC)CC(O)CN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C12H23N3O3/c1-5-14(6-2)7-9(16)8-15-10(17)12(3,4)13-11(15)18/h9,16H,5-8H2,1-4H3,(H,13,18)
InChIKeyNVZJRQFSGFQQHN-UHFFFAOYSA-N
XLogP0.02
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 99605
CID 99605
CID 117879
CID 117879
CID 647728
CID 647728
CID 650277
CID 650277
CID 3133125
CID 3133125
CID 648961
CID 648961
CID 2909886
CID 2909886
CID 18993
CID 18993
CID 652154
CID 652154
CID 2884173
CID 2884173
CID 3145439
CID 3145439
CID 2884424
CID 2884424

Frequently Asked Questions

What is the IUPAC name of 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione (CID 2909095) is 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione is CCN(CC)CC(O)CN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is NVZJRQFSGFQQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-5-14(6-2)7-9(16)8-15-10(17)12(3,4)13-11(15)18/h9,16H,5-8H2,1-4H3,(H,13,18).
What are the key properties of 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione?
3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 257.33 g/mol, XLogP of 0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(diethylamino)-2-hydroxypropyl]-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 2909095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).