3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one

C10H21N3O — CID 83249108

IUPAC3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one
SMILESCC(CCN(C)C)N1C(=O)CNC1C
InChIInChI=1S/C10H21N3O/c1-8(5-6-12(3)4)13-9(2)11-7-10(13)14/h8-9,11H,5-7H2,1-4H3
InChIKeyFWYGAHFHWKTFLW-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.10
Rot. Bonds4

About 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one

3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one (PubChem CID 83249108) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one.

Molecular Properties

Compound Name3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one
PubChem CID83249108
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one
SMILESCC(CCN(C)C)N1C(=O)CNC1C
InChIInChI=1S/C10H21N3O/c1-8(5-6-12(3)4)13-9(2)11-7-10(13)14/h8-9,11H,5-7H2,1-4H3
InChIKeyFWYGAHFHWKTFLW-UHFFFAOYSA-N
XLogP0.10
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one?
The IUPAC name of 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one (CID 83249108) is 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one.
What is the SMILES notation for 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one?
The canonical SMILES for 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one is CC(CCN(C)C)N1C(=O)CNC1C.
What is the InChIKey of 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one?
The InChIKey is FWYGAHFHWKTFLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8(5-6-12(3)4)13-9(2)11-7-10(13)14/h8-9,11H,5-7H2,1-4H3.
What are the key properties of 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one?
3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one has a molecular weight of 199.30 g/mol, XLogP of 0.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one is sourced from PubChem (CID 83249108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).